Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

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766 – 780 of 202,914 results

766

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Sesame Oil, NF, Spectrum™ Chemical

CAS: 8008-74-0

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CAS	8008-74-0

767

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3,4,5-Trimethoxybenzoic acid, 99+%

CAS: 118-41-2 Molecular Formula: C10H12O5 Molecular Weight (g/mol): 212.2 MDL Number: MFCD00002501 InChI Key: SJSOFNCYXJUNBT-UHFFFAOYSA-N Synonym: eudesmic acid,gallic acid trimethyl ether,tri-o-methylgallic acid,trimethylgallic acid,benzoic acid, 3,4,5-trimethoxy,veratric acid, 5-methoxy,unii-v5c9h0sc9f,3,4,5-trimethoxy-benzoic acid,5-methoxy-veratric acid,v5c9h0sc9f PubChem CID: 8357 ChEBI: CHEBI:454991 IUPAC Name: 3,4,5-trimethoxybenzoic acid SMILES: COC1=CC(=CC(OC)=C1OC)C(O)=O

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Specifications

PubChem CID	8357
CAS	118-41-2
Molecular Weight (g/mol)	212.2
ChEBI	CHEBI:454991
MDL Number	MFCD00002501
SMILES	COC1=CC(=CC(OC)=C1OC)C(O)=O
Synonym	eudesmic acid,gallic acid trimethyl ether,tri-o-methylgallic acid,trimethylgallic acid,benzoic acid, 3,4,5-trimethoxy,veratric acid, 5-methoxy,unii-v5c9h0sc9f,3,4,5-trimethoxy-benzoic acid,5-methoxy-veratric acid,v5c9h0sc9f
IUPAC Name	3,4,5-trimethoxybenzoic acid
InChI Key	SJSOFNCYXJUNBT-UHFFFAOYSA-N
Molecular Formula	C10H12O5

768

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Palonosetron hydrochloride

CAS: 135729-62-3 Molecular Formula: C19H25ClN2O Molecular Weight (g/mol): 332.87 MDL Number: MFCD00939524 InChI Key: OLDRWYVIKMSFFB-KPVRICSOSA-N IUPAC Name: hydrogen (5R)-3-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-3-azatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-trien-2-one chloride SMILES: [H+].[Cl-].O=C1N(C[C@@H]2CCCC3=CC=CC1=C23)[C@@H]1CN2CCC1CC2

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Specifications

CAS	135729-62-3
Molecular Weight (g/mol)	332.87
MDL Number	MFCD00939524
SMILES	[H+].[Cl-].O=C1N(C[C@@H]2CCCC3=CC=CC1=C23)[C@@H]1CN2CCC1CC2
IUPAC Name	hydrogen (5R)-3-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-3-azatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-trien-2-one chloride
InChI Key	OLDRWYVIKMSFFB-KPVRICSOSA-N
Molecular Formula	C19H25ClN2O

769

Thermo Scientific Chemicals L-Tyrosine methyl ester, 98%

CAS: 1080-06-4 Molecular Formula: C10H13NO3 Molecular Weight (g/mol): 195.22 MDL Number: MFCD00002392 InChI Key: MWZPENIJLUWBSY-VIFPVBQESA-N Synonym: l-tyrosine methyl ester,h-tyr-ome,tyrosine methyl ester,methyl l-tyrosinate,tyr-ome,methyl tyrosinate,tyrosine, methyl ester,s-2-amino-3-4-hydroxy-phenyl-propionic acid methyl ester,methyl 2s-2-amino-3-4-hydroxyphenyl propanoate,s-methyl 2-amino-3-4-hydroxyphenyl propanoate PubChem CID: 70652 ChEBI: CHEBI:17215 IUPAC Name: methyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate SMILES: COC(=O)[C@@H](N)CC1=CC=C(O)C=C1

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Specifications

PubChem CID	70652
CAS	1080-06-4
Molecular Weight (g/mol)	195.22
ChEBI	CHEBI:17215
MDL Number	MFCD00002392
SMILES	COC(=O)[C@@H](N)CC1=CC=C(O)C=C1
Synonym	l-tyrosine methyl ester,h-tyr-ome,tyrosine methyl ester,methyl l-tyrosinate,tyr-ome,methyl tyrosinate,tyrosine, methyl ester,s-2-amino-3-4-hydroxy-phenyl-propionic acid methyl ester,methyl 2s-2-amino-3-4-hydroxyphenyl propanoate,s-methyl 2-amino-3-4-hydroxyphenyl propanoate
IUPAC Name	methyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate
InChI Key	MWZPENIJLUWBSY-VIFPVBQESA-N
Molecular Formula	C10H13NO3

770

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4-Amino-3-nitrophenylboronic acid pinacol ester, 97%, Thermo Scientific Chemicals

CAS: 833486-94-5 Molecular Formula: C12H17BN2O4 Molecular Weight (g/mol): 264.09 MDL Number: MFCD06795680 InChI Key: QOYJKGGBFKVKDP-UHFFFAOYSA-N Synonym: 4-amino-3-nitrophenylboronic acid pinacol ester,2-nitro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl aniline,benzenamine, 2-nitro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,4-amino-3-nitrophenylboronic acid, pinacol ester,2-4-amino-3-nitrophenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-nitro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzenamine,pubchem22339,acmc-209ps0,ksc912g7t,qoyjkggbfkvkdp-uhfffaoysa-n PubChem CID: 16217914 IUPAC Name: 2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(N)C(=C1)[N+]([O-])=O

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Specifications

PubChem CID	16217914
CAS	833486-94-5
Molecular Weight (g/mol)	264.09
MDL Number	MFCD06795680
SMILES	CC1(C)OB(OC1(C)C)C1=CC=C(N)C(=C1)[N+]([O-])=O
Synonym	4-amino-3-nitrophenylboronic acid pinacol ester,2-nitro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl aniline,benzenamine, 2-nitro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,4-amino-3-nitrophenylboronic acid, pinacol ester,2-4-amino-3-nitrophenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-nitro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzenamine,pubchem22339,acmc-209ps0,ksc912g7t,qoyjkggbfkvkdp-uhfffaoysa-n
IUPAC Name	2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
InChI Key	QOYJKGGBFKVKDP-UHFFFAOYSA-N
Molecular Formula	C12H17BN2O4

771

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Sarcosine tert-butyl ester hydrochloride, 97%

CAS: 5616-81-9 Molecular Formula: C7H16ClNO2 Molecular Weight (g/mol): 181.66 MDL Number: MFCD00080936 InChI Key: RNLQHMIDSCYLAK-UHFFFAOYSA-N Synonym: h-sar-otbu.hcl,tert-butyl 2-methylamino acetate hydrochloride,sarcosine tert-butyl ester hydrochloride,tert-butyl sarcosinate hydrochloride,tert-butylsarcosinate hydrochloride,h-sar-otbuhcl,sarcosine t-butyl ester hydrochloride,n-methylglycine t-butyl ester hydrochloride,glycine, n-methyl-, 1,1-dimethylethyl ester, hydrochloride,h-sar-otbu hcl PubChem CID: 11252350 IUPAC Name: tert-butyl 2-(methylamino)acetate;hydrochloride SMILES: CC(C)(C)OC(=O)CNC.Cl

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Specifications

PubChem CID	11252350
CAS	5616-81-9
Molecular Weight (g/mol)	181.66
MDL Number	MFCD00080936
SMILES	CC(C)(C)OC(=O)CNC.Cl
Synonym	h-sar-otbu.hcl,tert-butyl 2-methylamino acetate hydrochloride,sarcosine tert-butyl ester hydrochloride,tert-butyl sarcosinate hydrochloride,tert-butylsarcosinate hydrochloride,h-sar-otbuhcl,sarcosine t-butyl ester hydrochloride,n-methylglycine t-butyl ester hydrochloride,glycine, n-methyl-, 1,1-dimethylethyl ester, hydrochloride,h-sar-otbu hcl
IUPAC Name	tert-butyl 2-(methylamino)acetate;hydrochloride
InChI Key	RNLQHMIDSCYLAK-UHFFFAOYSA-N
Molecular Formula	C7H16ClNO2

772

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Phencyclone, 97%

CAS: 5660-91-3 Molecular Formula: C29H18O Molecular Weight (g/mol): 382.46 MDL Number: MFCD00051451 InChI Key: MNSDGJFEKUKHGO-UHFFFAOYSA-N Synonym: phencyclone,1,3-diphenyl-2h-cyclopenta l phenanthren-2-one,1,3-diphenylcyclopenta l phenanthren-2-one,1,3-diphenylcyclopenta 1,2-l phenanthren-2-one PubChem CID: 97140 ChEBI: CHEBI:48304 IUPAC Name: 1,3-diphenylcyclopenta[l]phenanthren-2-one SMILES: O=C1C(=C2C(=C1C1=CC=CC=C1)C1=CC=CC=C1C1=CC=CC=C21)C1=CC=CC=C1

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Specifications

PubChem CID	97140
CAS	5660-91-3
Molecular Weight (g/mol)	382.46
ChEBI	CHEBI:48304
MDL Number	MFCD00051451
SMILES	O=C1C(=C2C(=C1C1=CC=CC=C1)C1=CC=CC=C1C1=CC=CC=C21)C1=CC=CC=C1
Synonym	phencyclone,1,3-diphenyl-2h-cyclopenta l phenanthren-2-one,1,3-diphenylcyclopenta l phenanthren-2-one,1,3-diphenylcyclopenta 1,2-l phenanthren-2-one
IUPAC Name	1,3-diphenylcyclopenta[l]phenanthren-2-one
InChI Key	MNSDGJFEKUKHGO-UHFFFAOYSA-N
Molecular Formula	C29H18O

773

2-Methyl-L-cysteine hydrochloride, 98%, 98% ee

CAS: 148766-37-4 Molecular Formula: C₄H₉NO₂S·ClH Molecular Weight (g/mol): 171.65 InChI Key: MAGCVRLGTQSVGF-WCCKRBBISA-N Synonym: r-2-amino-3-mercapto-2-methylpropanoic acid hydrochloride,r-2-methylcysteine hcl,r-2-methylcysteine hydrochloride,cysteine, 2-methyl-, hydrochloride,r-2-amino-3-mercapto-2-methyl-propionic acid hydrochloride,2r-2-amino-2-methyl-3-sulfanyl-propanoic acid hydrochloride,2r-2-amino-2-methyl-3-sulfanylpropanoic acid hydrochloride,2r-2-amino-3-mercapto-2-methylpropanoic acid,l-cysteine, 2-methyl-,hydrochloride 1:1,r-l-methylcysteine?hcl PubChem CID: 16679763 IUPAC Name: (2R)-2-amino-2-methyl-3-sulfanylpropanoic acid;hydrochloride SMILES: CC(CS)(C(=O)O)N.Cl

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Specifications

PubChem CID	16679763
CAS	148766-37-4
Molecular Weight (g/mol)	171.65
SMILES	CC(CS)(C(=O)O)N.Cl
Synonym	r-2-amino-3-mercapto-2-methylpropanoic acid hydrochloride,r-2-methylcysteine hcl,r-2-methylcysteine hydrochloride,cysteine, 2-methyl-, hydrochloride,r-2-amino-3-mercapto-2-methyl-propionic acid hydrochloride,2r-2-amino-2-methyl-3-sulfanyl-propanoic acid hydrochloride,2r-2-amino-2-methyl-3-sulfanylpropanoic acid hydrochloride,2r-2-amino-3-mercapto-2-methylpropanoic acid,l-cysteine, 2-methyl-,hydrochloride 1:1,r-l-methylcysteine?hcl
IUPAC Name	(2R)-2-amino-2-methyl-3-sulfanylpropanoic acid;hydrochloride
InChI Key	MAGCVRLGTQSVGF-WCCKRBBISA-N
Molecular Formula	C₄H₉NO₂S·ClH

774

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Zanamivir monohydrate

CAS: 1260601-68-0 Molecular Formula: C12 H20 N4 O7 . H2 O Molecular Weight (g/mol): 350.33 MDL Number: MFCD00866966

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Specifications

CAS	1260601-68-0
Molecular Weight (g/mol)	350.33
MDL Number	MFCD00866966
Molecular Formula	C12 H20 N4 O7 . H2 O

775

4-Methylbenzhydrylamine hydrochloride, polymer-supported, 1% cross-linked, 100-200 mesh, 0.5-1.0 mmol/g on PS-DVB

CAS: 5267-49-2 Molecular Formula: C14H16ClN Molecular Weight (g/mol): 233.74 MDL Number: MFCD00801150 InChI Key: NHTZSJKMWBONMD-UHFFFAOYNA-N Synonym: 4-methylphenyl phenyl methanamine hydrochloride,4-methylphenyl phenyl methyl amine hydrochloride,4-methylbenzhydrylamine hydrochloride,phenyl p-tolyl methanamine hydrochloride,4-methylphenyl phenyl methyl amine hcl,4-methylphenyl-phenylmethanamine hydrochloride PubChem CID: 2734294

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Specifications

PubChem CID	2734294
CAS	5267-49-2
Molecular Weight (g/mol)	233.74
MDL Number	MFCD00801150
Synonym	4-methylphenyl phenyl methanamine hydrochloride,4-methylphenyl phenyl methyl amine hydrochloride,4-methylbenzhydrylamine hydrochloride,phenyl p-tolyl methanamine hydrochloride,4-methylphenyl phenyl methyl amine hcl,4-methylphenyl-phenylmethanamine hydrochloride
InChI Key	NHTZSJKMWBONMD-UHFFFAOYNA-N
Molecular Formula	C14H16ClN

776

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Ethyl (R)-(+)-1-Boc-4-oxopiperidine-2-carboxylate, 95%, Thermo Scientific™

CAS: 357154-16-6 Molecular Formula: C13H21NO5 Molecular Weight (g/mol): 271.313 MDL Number: MFCD20526405 InChI Key: YAVQLRUBKDCOCI-SNVBAGLBSA-N Synonym: r-1-tert-butyl 2-ethyl 4-oxopiperidine-1,2-dicarboxylate,ethyl r-1-boc-4-oxopiperidine-2-carboxylate,r-+-1-boc-4-oxopiperidine-2-carboxylic acid ethyl ester,r-1-boc-4-oxopiperidine-2-carboxylic acid ethyl ester,ethyl r-+-1-boc-4-oxopiperidine-2-carboxylate,ethyl r-+-1-boc-4-oxopipecolate,r-1-tert-butyl-2-ethyl-4-oxopiperidine-1,2-dicarboxylate,2r-4-oxopiperidine-1,2-dicarboxylic acid 1-tert-butyl 2-ethyl ester,1-tert-butyl 2-ethyl 2r-4-oxopiperidine-1,2-dicarboxylate PubChem CID: 67586303 IUPAC Name: 1-O-tert-butyl 2-O-ethyl (2R)-4-oxopiperidine-1,2-dicarboxylate SMILES: CCOC(=O)C1CC(=O)CCN1C(=O)OC(C)(C)C

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Specifications

PubChem CID	67586303
CAS	357154-16-6
Molecular Weight (g/mol)	271.313
MDL Number	MFCD20526405
SMILES	CCOC(=O)C1CC(=O)CCN1C(=O)OC(C)(C)C
Synonym	r-1-tert-butyl 2-ethyl 4-oxopiperidine-1,2-dicarboxylate,ethyl r-1-boc-4-oxopiperidine-2-carboxylate,r-+-1-boc-4-oxopiperidine-2-carboxylic acid ethyl ester,r-1-boc-4-oxopiperidine-2-carboxylic acid ethyl ester,ethyl r-+-1-boc-4-oxopiperidine-2-carboxylate,ethyl r-+-1-boc-4-oxopipecolate,r-1-tert-butyl-2-ethyl-4-oxopiperidine-1,2-dicarboxylate,2r-4-oxopiperidine-1,2-dicarboxylic acid 1-tert-butyl 2-ethyl ester,1-tert-butyl 2-ethyl 2r-4-oxopiperidine-1,2-dicarboxylate
IUPAC Name	1-O-tert-butyl 2-O-ethyl (2R)-4-oxopiperidine-1,2-dicarboxylate
InChI Key	YAVQLRUBKDCOCI-SNVBAGLBSA-N
Molecular Formula	C13H21NO5

777

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L-2,4-Diaminobutyric acid dihydrochloride, 98+%, may cont. up to ca 10% monohydrochloride

CAS: 1883-09-6 Molecular Formula: C4H12Cl2N2O2 Molecular Weight (g/mol): 191.052 MDL Number: MFCD00064561 InChI Key: CKAAWCHIBBNLOJ-QTNFYWBSSA-N Synonym: l-2,4-diaminobutyric acid dihydrochloride,s-2,4-diaminobutanoic acid dihydrochloride,s-+-2,4-diaminobutyric acid dihydrochloride,h-dab-oh.2hcl,2,4-diaminobutyric acid dihydrochloride,2s-2,4-diaminobutanoic acid dihydrochloride,s-+-2,4-diamino-n-butyric acid dihydrochloride,butanoic acid, 2,4-diamino-, dihydrochloride, 2s,d-dab.2hcl,2s-2,4-diaminobutanoic acid, chloride, chloride PubChem CID: 2724265 IUPAC Name: (2S)-2,4-diaminobutanoic acid;dihydrochloride SMILES: C(CN)C(C(=O)O)N.Cl.Cl

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Specifications

PubChem CID	2724265
CAS	1883-09-6
Molecular Weight (g/mol)	191.052
MDL Number	MFCD00064561
SMILES	C(CN)C(C(=O)O)N.Cl.Cl
Synonym	l-2,4-diaminobutyric acid dihydrochloride,s-2,4-diaminobutanoic acid dihydrochloride,s-+-2,4-diaminobutyric acid dihydrochloride,h-dab-oh.2hcl,2,4-diaminobutyric acid dihydrochloride,2s-2,4-diaminobutanoic acid dihydrochloride,s-+-2,4-diamino-n-butyric acid dihydrochloride,butanoic acid, 2,4-diamino-, dihydrochloride, 2s,d-dab.2hcl,2s-2,4-diaminobutanoic acid, chloride, chloride
IUPAC Name	(2S)-2,4-diaminobutanoic acid;dihydrochloride
InChI Key	CKAAWCHIBBNLOJ-QTNFYWBSSA-N
Molecular Formula	C4H12Cl2N2O2

778

Pregnenolone Acetate, MP Biomedicals™

CAS: 1778-02-5 Molecular Formula: C23H34O3 Molecular Weight (g/mol): 358.522 InChI Key: CRRKVZVYZQXICQ-BODHGXFRSA-N Synonym: 1s,5s,10s,11s,14s,15s,2r-14-acetyl-2,15-dimethyltetracyclo 8.7.0.0<2,7>.0<11 ,15> heptadec-7-en-5-yl acetate,11as-1-acetyl-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta a phenanthren-7-yl acetate,13s-17-ethanoyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta a phenanthren-3-yl ethanoate,acetic acid 13s-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta a phenanthren-3-yl ester PubChem CID: 18530247 IUPAC Name: [(13S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate SMILES: CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C

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Specifications

PubChem CID	18530247
CAS	1778-02-5
Molecular Weight (g/mol)	358.522
SMILES	CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C
Synonym	1s,5s,10s,11s,14s,15s,2r-14-acetyl-2,15-dimethyltetracyclo 8.7.0.0<2,7>.0<11 ,15> heptadec-7-en-5-yl acetate,11as-1-acetyl-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta a phenanthren-7-yl acetate,13s-17-ethanoyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta a phenanthren-3-yl ethanoate,acetic acid 13s-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta a phenanthren-3-yl ester
IUPAC Name	[(13S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
InChI Key	CRRKVZVYZQXICQ-BODHGXFRSA-N
Molecular Formula	C23H34O3

779

Beclometasone-17-Propionate, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

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780

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L-Serine, FCC, 98.5-101.5%, Spectrum™ Chemical

CAS: 56-45-1 Molecular Formula: C3H7NO3 Molecular Weight (g/mol): 105.09 InChI Key: MTCFGRXMJLQNBG-UHFFFAOYNA-N IUPAC Name: 2-amino-3-hydroxypropanoic acid SMILES: NC(CO)C(O)=O

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Specifications

CAS	56-45-1
Molecular Weight (g/mol)	105.09
SMILES	NC(CO)C(O)=O
IUPAC Name	2-amino-3-hydroxypropanoic acid
InChI Key	MTCFGRXMJLQNBG-UHFFFAOYNA-N
Molecular Formula	C3H7NO3

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