Piperazines

Organic heterocyclic compounds that consist of a six-membered ring with four carbon atoms and two nitrogen atoms at opposite positions in the ring.

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106 – 120 of 4,122 results

106

3-{[4-(tert-Butoxycarbonyl)piperazin-1-yl]methyl}benzoic acid, ≥97%, Thermo Scientific™

CAS: 500013-38-7 Molecular Formula: C17H24N2O4 Molecular Weight (g/mol): 320.389 MDL Number: MFCD04115219 InChI Key: CXJBKOKDFABTQO-UHFFFAOYSA-N Synonym: 3-4-tert-butoxycarbonyl piperazin-1-yl methyl benzoic acid,1-3-carboxyphenylmethyl-4-boc piperazine,1-boc-4-3-carboxy-benzyl-piperazine,3-4-n-boc-piperazin-1-yl methylbenzoic acid,1-tert-butoxycarbonyl-4-3-carboxybenzyl piperazine,tert-butyl 4-3-carboxybenzyl piperazine-1-carboxylate,3-4-tert-butoxy carbonyl piperazin-1-yl methyl benzoic acid,3-4-tert-butoxycarbonyl piperazin-1-yl methyl benzoicacid,1-piperazinecarboxylicacid, 4-3-carboxyphenyl methyl-, 1-1,1-dimethylethyl ester PubChem CID: 2795521 IUPAC Name: 3-[[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]methyl]benzoic acid SMILES: CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)O

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Specifications

PubChem CID	2795521
CAS	500013-38-7
Molecular Weight (g/mol)	320.389
MDL Number	MFCD04115219
SMILES	CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)O
Synonym	3-4-tert-butoxycarbonyl piperazin-1-yl methyl benzoic acid,1-3-carboxyphenylmethyl-4-boc piperazine,1-boc-4-3-carboxy-benzyl-piperazine,3-4-n-boc-piperazin-1-yl methylbenzoic acid,1-tert-butoxycarbonyl-4-3-carboxybenzyl piperazine,tert-butyl 4-3-carboxybenzyl piperazine-1-carboxylate,3-4-tert-butoxy carbonyl piperazin-1-yl methyl benzoic acid,3-4-tert-butoxycarbonyl piperazin-1-yl methyl benzoicacid,1-piperazinecarboxylicacid, 4-3-carboxyphenyl methyl-, 1-1,1-dimethylethyl ester
IUPAC Name	3-[[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]methyl]benzoic acid
InChI Key	CXJBKOKDFABTQO-UHFFFAOYSA-N
Molecular Formula	C17H24N2O4

107

tert-Butyl 4-[4-(hydroxymethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxylate, ≥97%, Thermo Scientific™

CAS: 158985-37-6 Molecular Formula: C16H24N2O3 Molecular Weight (g/mol): 292.379 MDL Number: MFCD06411543 InChI Key: PXKYXTXYWJKTSQ-UHFFFAOYSA-N Synonym: tert-butyl 4-4-hydroxymethyl phenyl piperazine-1-carboxylate,4-4-n-boc-piperazinyl benzyl alcohol,tert-butyl 4-4-hydroxymethyl phenyl tetrahydro-1 2h-pyrazinecarboxylate,4-4-n-boc-piperazinyl benzylalcohol,4-4-tert-butoxycarbonyl piperazine benzyl alcohol,pubchem11318,buttpark 98\06-99,4-1-boc-piperazin-4-yl phenylmethanol,4-4-tert-butoxycarbonyl piperazin-1-yl benzyl alcohol PubChem CID: 2795510 IUPAC Name: tert-butyl 4-[4-(hydroxymethyl)phenyl]piperazine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)CO

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Specifications

PubChem CID	2795510
CAS	158985-37-6
Molecular Weight (g/mol)	292.379
MDL Number	MFCD06411543
SMILES	CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)CO
Synonym	tert-butyl 4-4-hydroxymethyl phenyl piperazine-1-carboxylate,4-4-n-boc-piperazinyl benzyl alcohol,tert-butyl 4-4-hydroxymethyl phenyl tetrahydro-1 2h-pyrazinecarboxylate,4-4-n-boc-piperazinyl benzylalcohol,4-4-tert-butoxycarbonyl piperazine benzyl alcohol,pubchem11318,buttpark 98\06-99,4-1-boc-piperazin-4-yl phenylmethanol,4-4-tert-butoxycarbonyl piperazin-1-yl benzyl alcohol
IUPAC Name	tert-butyl 4-[4-(hydroxymethyl)phenyl]piperazine-1-carboxylate
InChI Key	PXKYXTXYWJKTSQ-UHFFFAOYSA-N
Molecular Formula	C16H24N2O3

108

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1-(2,3-Dichlorophenyl)piperazine monohydrochloride, 98+%, Thermo Scientific™

CAS: 119532-26-2 Molecular Formula: C10H13Cl3N2 Molecular Weight (g/mol): 267.578 MDL Number: MFCD00190238 InChI Key: CYQFNNSFAGXCEC-UHFFFAOYSA-N Synonym: 1-2,3-dichlorophenyl piperazine hydrochloride,1-2,3-dichlorophenyl piperazine monohydrochloride,1-2,3-dichlorophenyl-piperazine hydrochloride,2,3-dichlorophenylpiperazine hydrochloride,1-2,3-dichlorophenyl-piperazine monohydrochloride,1-2,3-dichlorophenyl piperazinehydrochloride,piperazine, 1-2,3-dichlorophenyl-, monohydrochloride,1-2,3-dichlorophenyl piperazine;hydrochloride,2,3-dichlorophenyl piperazine, chloride,zlchem 392 PubChem CID: 11630372 IUPAC Name: 1-(2,3-dichlorophenyl)piperazine;hydrochloride SMILES: C1CN(CCN1)C2=C(C(=CC=C2)Cl)Cl.Cl

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Specifications

PubChem CID	11630372
CAS	119532-26-2
Molecular Weight (g/mol)	267.578
MDL Number	MFCD00190238
SMILES	C1CN(CCN1)C2=C(C(=CC=C2)Cl)Cl.Cl
Synonym	1-2,3-dichlorophenyl piperazine hydrochloride,1-2,3-dichlorophenyl piperazine monohydrochloride,1-2,3-dichlorophenyl-piperazine hydrochloride,2,3-dichlorophenylpiperazine hydrochloride,1-2,3-dichlorophenyl-piperazine monohydrochloride,1-2,3-dichlorophenyl piperazinehydrochloride,piperazine, 1-2,3-dichlorophenyl-, monohydrochloride,1-2,3-dichlorophenyl piperazine;hydrochloride,2,3-dichlorophenyl piperazine, chloride,zlchem 392
IUPAC Name	1-(2,3-dichlorophenyl)piperazine;hydrochloride
InChI Key	CYQFNNSFAGXCEC-UHFFFAOYSA-N
Molecular Formula	C10H13Cl3N2

109

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1-(2-Pyridyl)piperazine, 99%

CAS: 34803-66-2 Molecular Formula: C9H13N3 Molecular Weight (g/mol): 163.224 MDL Number: MFCD00006216 InChI Key: GZRKXKUVVPSREJ-UHFFFAOYSA-N Synonym: 1-2-pyridyl piperazine,1-pyridin-2-yl piperazine,1-pyridin-2-yl-piperazine,1-2-pyridinyl piperazine,piperazine, 1-2-pyridinyl,2-pyridylpiperazine,pyridinylpiperazine,2-1-piperazinyl pyridine PubChem CID: 94459 IUPAC Name: 1-pyridin-2-ylpiperazine SMILES: C1CN(CCN1)C2=CC=CC=N2

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Specifications

PubChem CID	94459
CAS	34803-66-2
Molecular Weight (g/mol)	163.224
MDL Number	MFCD00006216
SMILES	C1CN(CCN1)C2=CC=CC=N2
Synonym	1-2-pyridyl piperazine,1-pyridin-2-yl piperazine,1-pyridin-2-yl-piperazine,1-2-pyridinyl piperazine,piperazine, 1-2-pyridinyl,2-pyridylpiperazine,pyridinylpiperazine,2-1-piperazinyl pyridine
IUPAC Name	1-pyridin-2-ylpiperazine
InChI Key	GZRKXKUVVPSREJ-UHFFFAOYSA-N
Molecular Formula	C9H13N3

110

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(R)-1-BOC-3-methylpiperazine, 99%

CAS: 163765-44-4 Molecular Formula: C₁₀H₂₀N₂O₂ Molecular Weight (g/mol): 200.28 MDL Number: MFCD02683205 InChI Key: FMLPQHJYUZTHQS-MRVPVSSYSA-N Synonym: r-1-boc-3-methylpiperazine,r-4-boc-2-methylpiperazine,r-4-n-boc-2-methylpiperazine,r-tert-butyl 3-methylpiperazine-1-carboxylate,tert-butyl 3r-3-methylpiperazine-1-carboxylate,r-4-n-boc-2-methyl-piperazine,r-1-boc-3-methyl-piperazine,r-4bocmp,r-n4-boc-2-methylpiperazine,3r-1-boc-3-methylpiperazine PubChem CID: 2756811 IUPAC Name: tert-butyl (3R)-3-methylpiperazine-1-carboxylate SMILES: CC1CN(CCN1)C(=O)OC(C)(C)C

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Specifications

PubChem CID	2756811
CAS	163765-44-4
Molecular Weight (g/mol)	200.28
MDL Number	MFCD02683205
SMILES	CC1CN(CCN1)C(=O)OC(C)(C)C
Synonym	r-1-boc-3-methylpiperazine,r-4-boc-2-methylpiperazine,r-4-n-boc-2-methylpiperazine,r-tert-butyl 3-methylpiperazine-1-carboxylate,tert-butyl 3r-3-methylpiperazine-1-carboxylate,r-4-n-boc-2-methyl-piperazine,r-1-boc-3-methyl-piperazine,r-4bocmp,r-n4-boc-2-methylpiperazine,3r-1-boc-3-methylpiperazine
IUPAC Name	tert-butyl (3R)-3-methylpiperazine-1-carboxylate
InChI Key	FMLPQHJYUZTHQS-MRVPVSSYSA-N
Molecular Formula	C₁₀H₂₀N₂O₂

111

1-Methyl-4-(3-nitrophenyl)piperazine, 97%, Thermo Scientific™

CAS: 148546-97-8 Molecular Formula: C11H15N3O2 Molecular Weight (g/mol): 221.26 MDL Number: MFCD08435858 InChI Key: IIRKKCDXJIXWHI-UHFFFAOYSA-N Synonym: 1-methyl-4-3-nitrophenyl piperazine,4-methyl-1-3-nitrophenyl piperazine,piperazine,1-methyl-4-3-nitrophenyl,zlchem 196,pubchem18685,acmc-209d0u,1-3-nitrophenyl 4-methylpiperazine,1-3-nitrophenyl-4-methylpiperazine,1-methyl-4-3-nitrophenyl-piperazine,1-methyl-4-3-nitro-phenyl-piperazine PubChem CID: 12152161 IUPAC Name: 1-methyl-4-(3-nitrophenyl)piperazine SMILES: CN1CCN(CC1)C1=CC(=CC=C1)[N+]([O-])=O

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Specifications

PubChem CID	12152161
CAS	148546-97-8
Molecular Weight (g/mol)	221.26
MDL Number	MFCD08435858
SMILES	CN1CCN(CC1)C1=CC(=CC=C1)[N+]([O-])=O
Synonym	1-methyl-4-3-nitrophenyl piperazine,4-methyl-1-3-nitrophenyl piperazine,piperazine,1-methyl-4-3-nitrophenyl,zlchem 196,pubchem18685,acmc-209d0u,1-3-nitrophenyl 4-methylpiperazine,1-3-nitrophenyl-4-methylpiperazine,1-methyl-4-3-nitrophenyl-piperazine,1-methyl-4-3-nitro-phenyl-piperazine
IUPAC Name	1-methyl-4-(3-nitrophenyl)piperazine
InChI Key	IIRKKCDXJIXWHI-UHFFFAOYSA-N
Molecular Formula	C11H15N3O2

112

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1-tert-Butylpiperazine, 97%

CAS: 38216-72-7 Molecular Formula: C8H18N2 Molecular Weight (g/mol): 142.246 MDL Number: MFCD00049359 InChI Key: PVMNSAIKFPWDQG-UHFFFAOYSA-N Synonym: n-tert-butylpiperazine,1-tert-butyl piperazine,n-t-butylpiperazine,1-t-butyl piperazine,1-tertbutyl piperazine,1-tert-butyl-piperazine,piperazine, 1-1,1-dimethylethyl,n-tert-butyl piperazine,tert-butylpiperazine,tert-butyl piperazine PubChem CID: 3530572 IUPAC Name: 1-tert-butylpiperazine SMILES: CC(C)(C)N1CCNCC1

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Specifications

PubChem CID	3530572
CAS	38216-72-7
Molecular Weight (g/mol)	142.246
MDL Number	MFCD00049359
SMILES	CC(C)(C)N1CCNCC1
Synonym	n-tert-butylpiperazine,1-tert-butyl piperazine,n-t-butylpiperazine,1-t-butyl piperazine,1-tertbutyl piperazine,1-tert-butyl-piperazine,piperazine, 1-1,1-dimethylethyl,n-tert-butyl piperazine,tert-butylpiperazine,tert-butyl piperazine
IUPAC Name	1-tert-butylpiperazine
InChI Key	PVMNSAIKFPWDQG-UHFFFAOYSA-N
Molecular Formula	C8H18N2

113

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1-Isopropylpiperazine, 98+%

CAS: 4318-42-7 Molecular Formula: C₇H₁₆N₂ Molecular Weight (g/mol): 128.22 MDL Number: MFCD00167971 InChI Key: WHKWMTXTYKVFLK-UHFFFAOYSA-N Synonym: 1-isopropylpiperazine,n-isopropylpiperazine,1-propan-2-yl piperazine,piperazine, 1-isopropyl,isopropyl piperazine,1-isopropyl-piperazine,1-1-methylethyl piperazine,n-isopropyl piperazine,1-isopropyl piperazine,piperazine, 1-1-methylethyl PubChem CID: 78013 IUPAC Name: 1-propan-2-ylpiperazine SMILES: CC(C)N1CCNCC1

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Specifications

PubChem CID	78013
CAS	4318-42-7
Molecular Weight (g/mol)	128.22
MDL Number	MFCD00167971
SMILES	CC(C)N1CCNCC1
Synonym	1-isopropylpiperazine,n-isopropylpiperazine,1-propan-2-yl piperazine,piperazine, 1-isopropyl,isopropyl piperazine,1-isopropyl-piperazine,1-1-methylethyl piperazine,n-isopropyl piperazine,1-isopropyl piperazine,piperazine, 1-1-methylethyl
IUPAC Name	1-propan-2-ylpiperazine
InChI Key	WHKWMTXTYKVFLK-UHFFFAOYSA-N
Molecular Formula	C₇H₁₆N₂

114

1-(4-Chlorophenyl)piperazine, 97%

CAS: 38212-33-8 Molecular Formula: C10H13ClN2 Molecular Weight (g/mol): 196.68 MDL Number: MFCD00044823 InChI Key: UNEIHNMKASENIG-UHFFFAOYSA-N Synonym: 1-4-chlorophenyl piperazine,piperazine, 1-4-chlorophenyl,1-4-chloro-phenyl-piperazine,para-chlorophenylpiperazine,pcpp,1-4-chlorophenyl-piperazine,p-chlorophenylpiperazine,4-chlorophenyl piperazine,1-4-chlorphenyl piperazin PubChem CID: 97478 IUPAC Name: 1-(4-chlorophenyl)piperazine SMILES: ClC1=CC=C(C=C1)N1CCNCC1

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Specifications

PubChem CID	97478
CAS	38212-33-8
Molecular Weight (g/mol)	196.68
MDL Number	MFCD00044823
SMILES	ClC1=CC=C(C=C1)N1CCNCC1
Synonym	1-4-chlorophenyl piperazine,piperazine, 1-4-chlorophenyl,1-4-chloro-phenyl-piperazine,para-chlorophenylpiperazine,pcpp,1-4-chlorophenyl-piperazine,p-chlorophenylpiperazine,4-chlorophenyl piperazine,1-4-chlorphenyl piperazin
IUPAC Name	1-(4-chlorophenyl)piperazine
InChI Key	UNEIHNMKASENIG-UHFFFAOYSA-N
Molecular Formula	C10H13ClN2

115

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4-(4-Isopropylpiperazin-1-yl)phenylboronic acid pinacol ester, 97%, Thermo Scientific Chemicals

CAS: 1073354-18-3 Molecular Formula: C19H31BN2O2 Molecular Weight (g/mol): 330.28 MDL Number: MFCD06795656 InChI Key: CSORKGLMGUQQOY-UHFFFAOYSA-N Synonym: 4-4-isopropylpiperizinyl phenylboronic acid, pinacol ester,1-isopropyl-4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl piperazine,4-4-isopropylpiperizinyl phenylboronic acid pinacol ester,4-4-isopropylpiperizinyl phenylboronicacid,pinacolester,4-4-isopropylpiperazinyl phenylboronic acid, pinacol ester,4-4-isopropylpiperizinyl benzeneboronic acid, pinacol ester,4-4-isopropylpiperazin-1-yl phenylboronic acid pinacol ester,1-propan-2-yl-4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl piperazine,1-isopropyl-4-4-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl piperazine PubChem CID: 17750254 IUPAC Name: 1-propan-2-yl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine SMILES: CC(C)N1CCN(CC1)C1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1

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Specifications

PubChem CID	17750254
CAS	1073354-18-3
Molecular Weight (g/mol)	330.28
MDL Number	MFCD06795656
SMILES	CC(C)N1CCN(CC1)C1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1
Synonym	4-4-isopropylpiperizinyl phenylboronic acid, pinacol ester,1-isopropyl-4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl piperazine,4-4-isopropylpiperizinyl phenylboronic acid pinacol ester,4-4-isopropylpiperizinyl phenylboronicacid,pinacolester,4-4-isopropylpiperazinyl phenylboronic acid, pinacol ester,4-4-isopropylpiperizinyl benzeneboronic acid, pinacol ester,4-4-isopropylpiperazin-1-yl phenylboronic acid pinacol ester,1-propan-2-yl-4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl piperazine,1-isopropyl-4-4-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl piperazine
IUPAC Name	1-propan-2-yl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine
InChI Key	CSORKGLMGUQQOY-UHFFFAOYSA-N
Molecular Formula	C19H31BN2O2

116

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4-(4-Boc-1-piperazinylmethyl)benzeneboronic acid pinacol ester, 95%

CAS: 936694-19-8 Molecular Formula: C22H35BN2O4 Molecular Weight (g/mol): 402.342 MDL Number: MFCD16294502 InChI Key: AAEYFMAHSYKHGD-UHFFFAOYSA-N Synonym: tert-butyl 4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzyl piperazine-1-carboxylate,tert-butyl 4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methyl piperazine-1-carboxylate,4-4-boc-piperazinomethyl phenylboronic acid, pinacol ester,4-4-boc-1-piperazinylmethyl benzeneboronic acid pinacol ester,amtb122,4-4-boc-piperazinemethyl phenylboronic acid pinacol ester,4-4-boc-piperazine methyl phenylboronic acid pinacol ester,tert-butyl 4-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl benzyl piperazine-1-carboxylate PubChem CID: 53216820 IUPAC Name: tert-butyl 4-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]piperazine-1-carboxylate SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)CN3CCN(CC3)C(=O)OC(C)(C)C

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Specifications

PubChem CID	53216820
CAS	936694-19-8
Molecular Weight (g/mol)	402.342
MDL Number	MFCD16294502
SMILES	B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)CN3CCN(CC3)C(=O)OC(C)(C)C
Synonym	tert-butyl 4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzyl piperazine-1-carboxylate,tert-butyl 4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methyl piperazine-1-carboxylate,4-4-boc-piperazinomethyl phenylboronic acid, pinacol ester,4-4-boc-1-piperazinylmethyl benzeneboronic acid pinacol ester,amtb122,4-4-boc-piperazinemethyl phenylboronic acid pinacol ester,4-4-boc-piperazine methyl phenylboronic acid pinacol ester,tert-butyl 4-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl benzyl piperazine-1-carboxylate
IUPAC Name	tert-butyl 4-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]piperazine-1-carboxylate
InChI Key	AAEYFMAHSYKHGD-UHFFFAOYSA-N
Molecular Formula	C22H35BN2O4

117

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Ketoconazole, USP, 98-102%, Spectrum™ Chemical

CAS: 65277-42-1 Molecular Formula: C26H28Cl2N4O4 Molecular Weight (g/mol): 531.43 InChI Key: XMAYWYJOQHXEEK-ZEQKJWHPSA-N IUPAC Name: 1-[4-(4-{[(2S,4R)-2-(2,4-dichlorophenyl)-2-[(1H-imidazol-1-yl)methyl]-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethan-1-one SMILES: CC(=O)N1CCN(CC1)C1=CC=C(OC[C@@H]2CO[C@](CN3C=CN=C3)(O2)C2=CC=C(Cl)C=C2Cl)C=C1

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Specifications

CAS	65277-42-1
Molecular Weight (g/mol)	531.43
SMILES	CC(=O)N1CCN(CC1)C1=CC=C(OC[C@@H]2CO[C@](CN3C=CN=C3)(O2)C2=CC=C(Cl)C=C2Cl)C=C1
IUPAC Name	1-[4-(4-{[(2S,4R)-2-(2,4-dichlorophenyl)-2-[(1H-imidazol-1-yl)methyl]-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethan-1-one
InChI Key	XMAYWYJOQHXEEK-ZEQKJWHPSA-N
Molecular Formula	C26H28Cl2N4O4

118

Ketoconazole, 2mg/mL in methanol, sterile-filtered, Thermo Scientific™

CAS: 65277-42-1 Molecular Formula: C26H28Cl2N4O4 Molecular Weight (g/mol): 534.452 MDL Number: MFCD00058579 InChI Key: XMAYWYJOQHXEEK-SIULDFEJSA-N Synonym: ketoconazole PubChem CID: 76973198 IUPAC Name: 2,2,2-trideuterio-1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone SMILES: CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OCC3COC(O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl

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Specifications

PubChem CID	76973198
CAS	65277-42-1
Molecular Weight (g/mol)	534.452
MDL Number	MFCD00058579
SMILES	CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OCC3COC(O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl
Synonym	ketoconazole
IUPAC Name	2,2,2-trideuterio-1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone
InChI Key	XMAYWYJOQHXEEK-SIULDFEJSA-N
Molecular Formula	C26H28Cl2N4O4

119

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1-Chloromethyl-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate), 98+%

CAS: 140681-55-6 Molecular Formula: C7H14B2ClF9N2 Molecular Weight (g/mol): 354.26 MDL Number: MFCD00142607 InChI Key: TXRPHPUGYLSHCX-UHFFFAOYSA-N Synonym: selectfluor,1-chloromethyl-4-fluoro-1,4-diazoniabicyclo 2.2.2 octane bis tetrafluoroborate,f-teda-bf4,1-chloromethyl-4-fluoro-1,4-diazabicyclo 2.2.2 octane-1,4-diium tetrafluoroborate,unii-4p1za6r76d,selectfluor fluorinating reagent,f-teda,selectfluor r fluorinating reagent,1-chloromethyl-4-fluoro-1,4-diazoniabicyclo 2.2.2 octane ditetrafluoroborate PubChem CID: 2724933 IUPAC Name: 1-(chloromethyl)-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane;ditetrafluoroborate SMILES: F[B-](F)(F)F.F[B-](F)(F)F.F[N+]12CC[N+](CCl)(CC1)CC2

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Specifications

PubChem CID	2724933
CAS	140681-55-6
Molecular Weight (g/mol)	354.26
MDL Number	MFCD00142607
SMILES	F[B-](F)(F)F.F[B-](F)(F)F.F[N+]12CC[N+](CCl)(CC1)CC2
Synonym	selectfluor,1-chloromethyl-4-fluoro-1,4-diazoniabicyclo 2.2.2 octane bis tetrafluoroborate,f-teda-bf4,1-chloromethyl-4-fluoro-1,4-diazabicyclo 2.2.2 octane-1,4-diium tetrafluoroborate,unii-4p1za6r76d,selectfluor fluorinating reagent,f-teda,selectfluor r fluorinating reagent,1-chloromethyl-4-fluoro-1,4-diazoniabicyclo 2.2.2 octane ditetrafluoroborate
IUPAC Name	1-(chloromethyl)-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane;ditetrafluoroborate
InChI Key	TXRPHPUGYLSHCX-UHFFFAOYSA-N
Molecular Formula	C7H14B2ClF9N2

120

Prazosin hydrochloride

CAS: 19237-84-4 Molecular Formula: C19H22ClN5O4 Molecular Weight (g/mol): 419.87 MDL Number: MFCD00058177 InChI Key: WFXFYZULCQKPIP-UHFFFAOYSA-N Synonym: prazosin hydrochloride,prazosin hcl,minipress,vasoflex,peripress,furazosin hydrochloride,deprazolin,hypovase,hypovasole,pratsiol PubChem CID: 68546 ChEBI: CHEBI:8365 IUPAC Name: hydrogen 2-[4-(furan-2-carbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine chloride SMILES: [H+].[Cl-].COC1=C(OC)C=C2C(N)=NC(=NC2=C1)N1CCN(CC1)C(=O)C1=CC=CO1

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Specifications

PubChem CID	68546
CAS	19237-84-4
Molecular Weight (g/mol)	419.87
ChEBI	CHEBI:8365
MDL Number	MFCD00058177
SMILES	[H+].[Cl-].COC1=C(OC)C=C2C(N)=NC(=NC2=C1)N1CCN(CC1)C(=O)C1=CC=CO1
Synonym	prazosin hydrochloride,prazosin hcl,minipress,vasoflex,peripress,furazosin hydrochloride,deprazolin,hypovase,hypovasole,pratsiol
IUPAC Name	hydrogen 2-[4-(furan-2-carbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine chloride
InChI Key	WFXFYZULCQKPIP-UHFFFAOYSA-N
Molecular Formula	C19H22ClN5O4

Piperazines

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