Unclassified Organic Compounds

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

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286 – 300 of 171,713 results

286

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Diphenyl phosphite, contains varying amounts of phenol and (C6H5O)3P

CAS: 4712-55-4 Molecular Formula: C₁₂H₁₁O₃P Molecular Weight (g/mol): 234.19 MDL Number: MFCD00044497 InChI Key: CDXVUROVRIFQMV-UHFFFAOYSA-N Synonym: diphenyl phosphite,diphenyl phosphonate,phosphonic acid, diphenyl ester,diphenoxyphosphine oxide,diphenyl hydrogen phosphite,phosphorous acid, diphenyl ester,unii-5144js6xum,phosphonic acid diphenyl ester,phenyl phosphonate, pho 2hpo,phenyl phosphonate pho 2hpo PubChem CID: 6327546 IUPAC Name: oxo(diphenoxy)phosphanium SMILES: C1=CC=C(C=C1)O[P+](=O)OC2=CC=CC=C2

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Specifications

PubChem CID	6327546
CAS	4712-55-4
Molecular Weight (g/mol)	234.19
MDL Number	MFCD00044497
SMILES	C1=CC=C(C=C1)O[P+](=O)OC2=CC=CC=C2
Synonym	diphenyl phosphite,diphenyl phosphonate,phosphonic acid, diphenyl ester,diphenoxyphosphine oxide,diphenyl hydrogen phosphite,phosphorous acid, diphenyl ester,unii-5144js6xum,phosphonic acid diphenyl ester,phenyl phosphonate, pho 2hpo,phenyl phosphonate pho 2hpo
IUPAC Name	oxo(diphenoxy)phosphanium
InChI Key	CDXVUROVRIFQMV-UHFFFAOYSA-N
Molecular Formula	C₁₂H₁₁O₃P

287

Betaine Anhydrous 97.0+%, TCI America™

CAS: 107-43-7 Molecular Formula: C5H11NO2 Molecular Weight (g/mol): 117.148 MDL Number: MFCD00012123 InChI Key: KWIUHFFTVRNATP-UHFFFAOYSA-N Synonym: betaine,glycine betaine,oxyneurine,lycine,trimethylglycine,abromine,trimethylglycocoll,glycylbetaine,glycocoll betaine,acidin-pepsin PubChem CID: 247 ChEBI: CHEBI:17750 IUPAC Name: 2-(trimethylazaniumyl)acetate SMILES: C[N+](C)(C)CC(=O)[O-]

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Specifications

PubChem CID	247
CAS	107-43-7
Molecular Weight (g/mol)	117.148
ChEBI	CHEBI:17750
MDL Number	MFCD00012123
SMILES	C[N+](C)(C)CC(=O)[O-]
Synonym	betaine,glycine betaine,oxyneurine,lycine,trimethylglycine,abromine,trimethylglycocoll,glycylbetaine,glycocoll betaine,acidin-pepsin
IUPAC Name	2-(trimethylazaniumyl)acetate
InChI Key	KWIUHFFTVRNATP-UHFFFAOYSA-N
Molecular Formula	C5H11NO2

288

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4-tert-Butylcyclohexanone, 99%

CAS: 98-53-3 Molecular Formula: C₁₀H₁₈O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00001642 InChI Key: YKFKEYKJGVSEIX-UHFFFAOYSA-N Synonym: 4-tert-butylcyclohexanone,4-tert-butyl cyclohexanone,p-tert-butylcyclohexanone,cyclohexanone, 4-1,1-dimethylethyl,cyclohexanone, p-tert-butyl,cyclohexanone, 4-tert-butyl,4-t-butylcyclohexanone,4-tert-butyl cyclohexan-1-one,.gamma.-tert-butylcyclohexanone,pubchem20244 PubChem CID: 7392 IUPAC Name: 4-tert-butylcyclohexan-1-one SMILES: CC(C)(C)C1CCC(=O)CC1

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Specifications

PubChem CID	7392
CAS	98-53-3
Molecular Weight (g/mol)	154.25
MDL Number	MFCD00001642
SMILES	CC(C)(C)C1CCC(=O)CC1
Synonym	4-tert-butylcyclohexanone,4-tert-butyl cyclohexanone,p-tert-butylcyclohexanone,cyclohexanone, 4-1,1-dimethylethyl,cyclohexanone, p-tert-butyl,cyclohexanone, 4-tert-butyl,4-t-butylcyclohexanone,4-tert-butyl cyclohexan-1-one,.gamma.-tert-butylcyclohexanone,pubchem20244
IUPAC Name	4-tert-butylcyclohexan-1-one
InChI Key	YKFKEYKJGVSEIX-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₈O

289

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Thermo Scientific Chemicals Sertraline hydrochloride

CAS: 79559-97-0 Molecular Formula: C₁₇H₁₇Cl₂N·HCl Molecular Weight (g/mol): 342.69 InChI Key: BLFQGGGGFNSJKA-XHXSRVRCSA-N PubChem CID: 63009 ChEBI: CHEBI:9124

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Specifications

PubChem CID	63009
CAS	79559-97-0
Molecular Weight (g/mol)	342.69
ChEBI	CHEBI:9124
InChI Key	BLFQGGGGFNSJKA-XHXSRVRCSA-N
Molecular Formula	C₁₇H₁₇Cl₂N·HCl

290

Colchicine, 98%

CAS: 64-86-8 Molecular Formula: C22H25NO6 Molecular Weight (g/mol): 399.44 MDL Number: MFCD00078484,MFCD00078484 InChI Key: IAKHMKGGTNLKSZ-INIZCTEOSA-N Synonym: colchicine,colchicina,colchicin,condylon,colchicinum,colchisol,colsaloid,colcin,colchineos,7alphah-colchicine PubChem CID: 45038708 IUPAC Name: 2,2,2-trideuterio-N-[(7S)-1,2,3-trimethoxy-9-oxo-10-(trideuteriomethoxy)-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide SMILES: COC1=C(OC)C(OC)=C2C(CC[C@H](NC(C)=O)C3=CC(=O)C(OC)=CC=C23)=C1

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Specifications

PubChem CID	45038708
CAS	64-86-8
Molecular Weight (g/mol)	399.44
MDL Number	MFCD00078484,MFCD00078484
SMILES	COC1=C(OC)C(OC)=C2C(CC[C@H](NC(C)=O)C3=CC(=O)C(OC)=CC=C23)=C1
Synonym	colchicine,colchicina,colchicin,condylon,colchicinum,colchisol,colsaloid,colcin,colchineos,7alphah-colchicine
IUPAC Name	2,2,2-trideuterio-N-[(7S)-1,2,3-trimethoxy-9-oxo-10-(trideuteriomethoxy)-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
InChI Key	IAKHMKGGTNLKSZ-INIZCTEOSA-N
Molecular Formula	C22H25NO6

291

Tetrasodium N,N-Bis(carboxymethyl)-L-glutamate (ca. 40% in Water), TCI America™

CAS: 51981-21-6 Molecular Formula: C9H9NNa4O8 Molecular Weight (g/mol): 351.129 MDL Number: MFCD01862262 InChI Key: UZVUJVFQFNHRSY-OUTKXMMCSA-J Synonym: N,N-Bis(carboxymethyl)-L-glutamic Acid Tetrasodium Salt PubChem CID: 44630158 IUPAC Name: tetrasodium;(2S)-2-[bis(carboxylatomethyl)amino]pentanedioate SMILES: C(CC(=O)[O-])C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]

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Specifications

PubChem CID	44630158
CAS	51981-21-6
Molecular Weight (g/mol)	351.129
MDL Number	MFCD01862262
SMILES	C(CC(=O)[O-])C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]
Synonym	N,N-Bis(carboxymethyl)-L-glutamic Acid Tetrasodium Salt
IUPAC Name	tetrasodium;(2S)-2-[bis(carboxylatomethyl)amino]pentanedioate
InChI Key	UZVUJVFQFNHRSY-OUTKXMMCSA-J
Molecular Formula	C9H9NNa4O8

292

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Tropolone, 98%

CAS: 533-75-5 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.123 MDL Number: MFCD00004158 InChI Key: MDYOLVRUBBJPFM-UHFFFAOYSA-N Synonym: tropolone,purpurocatechol,2-hydroxycyclohepta-2,4,6-trienone,2,4,6-cycloheptatrien-1-one, 2-hydroxy,2-hydroxytropone,2-hydroxy-2,4,6-cycloheptatrien-1-one,2-hydroxy-2,4,6-cycloheptatrienone,unii-7l6dl16p1t,ccris 6609,tropomyosins PubChem CID: 10789 ChEBI: CHEBI:79966 IUPAC Name: 2-hydroxycyclohepta-2,4,6-trien-1-one SMILES: C1=CC=C(C(=O)C=C1)O

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Specifications

PubChem CID	10789
CAS	533-75-5
Molecular Weight (g/mol)	122.123
ChEBI	CHEBI:79966
MDL Number	MFCD00004158
SMILES	C1=CC=C(C(=O)C=C1)O
Synonym	tropolone,purpurocatechol,2-hydroxycyclohepta-2,4,6-trienone,2,4,6-cycloheptatrien-1-one, 2-hydroxy,2-hydroxytropone,2-hydroxy-2,4,6-cycloheptatrien-1-one,2-hydroxy-2,4,6-cycloheptatrienone,unii-7l6dl16p1t,ccris 6609,tropomyosins
IUPAC Name	2-hydroxycyclohepta-2,4,6-trien-1-one
InChI Key	MDYOLVRUBBJPFM-UHFFFAOYSA-N
Molecular Formula	C7H6O2

293

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(+)-Catechin hydrate

CAS: 225937-10-0 Molecular Formula: C15H14O6 Molecular Weight (g/mol): 290.27 MDL Number: MFCD00150865 InChI Key: PFTAWBLQPZVEMU-UYWMCZCJNA-N IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol hydrate SMILES: O[C@H]1CC2=C(O)C=C(O)C=C2O[C@@H]1C1=CC=C(O)C(O)=C1

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Specifications

CAS	225937-10-0
Molecular Weight (g/mol)	290.27
MDL Number	MFCD00150865
SMILES	O[C@H]1CC2=C(O)C=C(O)C=C2O[C@@H]1C1=CC=C(O)C(O)=C1
IUPAC Name	2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol hydrate
InChI Key	PFTAWBLQPZVEMU-UYWMCZCJNA-N
Molecular Formula	C15H14O6

294

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Bis(cyclopentadienyl)zirconium hydridochloride, 95%, Thermo Scientific Chemicals

CAS: 37342-97-5 Molecular Formula: C10H11ClZr-2 Molecular Weight (g/mol): 257.872 MDL Number: MFCD02089401 InChI Key: VPQMECJLNPUNGN-UHFFFAOYSA-M Synonym: zirconocene chloride hydride PubChem CID: 131718033 IUPAC Name: cyclopenta-1,3-diene;hydride;zirconium(2+);chloride SMILES: [H-].[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Zr+2]

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Specifications

PubChem CID	131718033
CAS	37342-97-5
Molecular Weight (g/mol)	257.872
MDL Number	MFCD02089401
SMILES	[H-].[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Zr+2]
Synonym	zirconocene chloride hydride
IUPAC Name	cyclopenta-1,3-diene;hydride;zirconium(2+);chloride
InChI Key	VPQMECJLNPUNGN-UHFFFAOYSA-M
Molecular Formula	C10H11ClZr-2

295

5-(N-2,3-Dihydroxypropylacetimido)-2,4,6-triiodo-N,N'-bis-(2,3-dihydroxypropyl)isophthalamide, MP Biomedicals™

CAS: 66108-95-0 Molecular Formula: C19H26I3N3O9 Molecular Weight (g/mol): 821.14 MDL Number: MFCD00077732 InChI Key: NTHXOOBQLCIOLC-UHFFFAOYNA-N Synonym: Nycodenz,Histodenz™

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Specifications

CAS	66108-95-0
Molecular Weight (g/mol)	821.14
MDL Number	MFCD00077732
Synonym	Nycodenz,Histodenz™
InChI Key	NTHXOOBQLCIOLC-UHFFFAOYNA-N
Molecular Formula	C19H26I3N3O9

296

Bortezomib, 98%

CAS: 179324-69-7 Molecular Formula: C19H25BN4O4 Molecular Weight (g/mol): 384.243 MDL Number: MFCD09056737 InChI Key: GXJABQQUPOEUTA-RDJZCZTQSA-N Synonym: bortezomib,velcade,bortezomib ps-341,dpba,pyz-phe-boroleu,unii-69g8bd63pp,velcade tn,bortezomib velcade,1r-3-methyl-1-2s-1-oxo-3-phenyl-2-pyrazinylcarbonyl amino propyl amino butyl boronic acid,1r-3-methyl-1-2s-3-phenyl-2-pyrazine-2-carbonylamino propanoyl amino butyl boronic acid PubChem CID: 387447 ChEBI: CHEBI:52717 IUPAC Name: [(1R)-3-methyl-1-[[(2S)-3-phenyl-2-(pyrazine-2-carbonylamino)propanoyl]amino]butyl]boronic acid SMILES: B(C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=NC=CN=C2)(O)O

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Specifications

PubChem CID	387447
CAS	179324-69-7
Molecular Weight (g/mol)	384.243
ChEBI	CHEBI:52717
MDL Number	MFCD09056737
SMILES	B(C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=NC=CN=C2)(O)O
Synonym	bortezomib,velcade,bortezomib ps-341,dpba,pyz-phe-boroleu,unii-69g8bd63pp,velcade tn,bortezomib velcade,1r-3-methyl-1-2s-1-oxo-3-phenyl-2-pyrazinylcarbonyl amino propyl amino butyl boronic acid,1r-3-methyl-1-2s-3-phenyl-2-pyrazine-2-carbonylamino propanoyl amino butyl boronic acid
IUPAC Name	[(1R)-3-methyl-1-[[(2S)-3-phenyl-2-(pyrazine-2-carbonylamino)propanoyl]amino]butyl]boronic acid
InChI Key	GXJABQQUPOEUTA-RDJZCZTQSA-N
Molecular Formula	C19H25BN4O4

297

Hydroxocobalamin Acetate 90.0+%, TCI America™

CAS: 22465-48-1 Molecular Formula: C64H92CoN13O16P Molecular Weight (g/mol): 1389.42 MDL Number: MFCD00082532 InChI Key: YKDAZHZZVTXKEY-FIJLCNGJSA-M Synonym: hydroxocobalamin acetate PubChem CID: 91972123 IUPAC Name: λ²-cobalt(2+) (2R,3S,4S,6Z,8S,9S,11Z,16Z,18R)-4,9,14-tris(2-carbamoylethyl)-3,8,19-tris(carbamoylmethyl)-18-{2-[(2-{[(2R,3S,4R,5S)-5-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl phosphonato]oxy}propyl)carbamoyl]ethyl}-2,3,6,8,13,13,16,18-octamethyl-20λ⁵,21,22,23-tetraazapentacyclo[15.2.1.1²,⁵.1⁷,¹⁰.1¹²,¹⁵]tricosa-5(23),6,10(22),11,15(21),16-hexaene-20,20-diid-20-yl hydrogen ethanehydrogen carboxylate SMILES: [Co++].CC([OH-])=O.CC(CNC(=O)CC[C@]1(C)C(CC(N)=O)C2[N--]\C1=C(C)/C1=N/C(=C\C3=N\C(=C(C)/C4=N[C@]2(C)[C@@](C)(CC(N)=O)[C@@H]4CCC(N)=O)\[C@@](C)(CC(N)=O)[C@@H]3CCC(N)=O)/C(C)(C)C1CCC(N)=O)OP([O-])(=O)O[C@@H]1[C@@H](CO)O[C@@H]([C@@H]1O)N1C=NC2=CC(C)=C(C)C=C12

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Specifications

PubChem CID	91972123
CAS	22465-48-1
Molecular Weight (g/mol)	1389.42
MDL Number	MFCD00082532
SMILES	[Co++].CC([OH-])=O.CC(CNC(=O)CC[C@]1(C)C(CC(N)=O)C2[N--]\C1=C(C)/C1=N/C(=C\C3=N\C(=C(C)/C4=N[C@]2(C)[C@@](C)(CC(N)=O)[C@@H]4CCC(N)=O)\[C@@](C)(CC(N)=O)[C@@H]3CCC(N)=O)/C(C)(C)C1CCC(N)=O)OP([O-])(=O)O[C@@H]1[C@@H](CO)O[C@@H]([C@@H]1O)N1C=NC2=CC(C)=C(C)C=C12
Synonym	hydroxocobalamin acetate
IUPAC Name	λ²-cobalt(2+) (2R,3S,4S,6Z,8S,9S,11Z,16Z,18R)-4,9,14-tris(2-carbamoylethyl)-3,8,19-tris(carbamoylmethyl)-18-{2-[(2-{[(2R,3S,4R,5S)-5-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl phosphonato]oxy}propyl)carbamoyl]ethyl}-2,3,6,8,13,13,16,18-octamethyl-20λ⁵,21,22,23-tetraazapentacyclo[15.2.1.1²,⁵.1⁷,¹⁰.1¹²,¹⁵]tricosa-5(23),6,10(22),11,15(21),16-hexaene-20,20-diid-20-yl hydrogen ethanehydrogen carboxylate
InChI Key	YKDAZHZZVTXKEY-FIJLCNGJSA-M
Molecular Formula	C64H92CoN13O16P

298

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2-Methylcyclohexanone, 98%

CAS: 583-60-8 InChI Key: LFSAPCRASZRSKS-UHFFFAOYSA-N Synonym: 2-methylcyclohexanone,o-methylcyclohexanone,cyclohexanone, 2-methyl,2-metilcicloesanone,2-methyl-1-cyclohexanone,methylanon,alpha-methylcyclohexanone,sexton b,2-methyl-cyclohexanon,2-methyl cyclohexanone PubChem CID: 11419 IUPAC Name: 2-methylcyclohexan-1-one SMILES: CC1CCCCC1=O

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Specifications

PubChem CID	11419
CAS	583-60-8
SMILES	CC1CCCCC1=O
Synonym	2-methylcyclohexanone,o-methylcyclohexanone,cyclohexanone, 2-methyl,2-metilcicloesanone,2-methyl-1-cyclohexanone,methylanon,alpha-methylcyclohexanone,sexton b,2-methyl-cyclohexanon,2-methyl cyclohexanone
IUPAC Name	2-methylcyclohexan-1-one
InChI Key	LFSAPCRASZRSKS-UHFFFAOYSA-N

299

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Thermo Scientific Chemicals beta-Apo-oxytetracycline, 'can be used as secondary standard'

CAS: 18751-99-0 Molecular Formula: C₂₂H₂₂N₂O₈ Molecular Weight (g/mol): 442.39 MDL Number: MFCD00062827 InChI Key: DRKMHDAKULCOKQ-UHFFFAOYSA-N Synonym: beta-apo-oxytetracycline,alpha-apo-oxytetracycline,alpha-apooxytetracycline,alpha-apoterramycin,beta-apo oxytetracycline,2z-2-amino hydroxy methylidene-5-4,5-dihydroxy-9-methyl-3-oxo-1h-benzo f 2 benzofuran-1-yl-4-dimethylamino-6-hydroxycyclohexane-1,3-dione,4-1,3-dihydro-4,5-dihydroxy-9-methyl-3-oxonaphtho 2,3-c furan-1-yl-3-dimethylamino-2,5-dihydroxy-6-oxo-1-cyclohexene-1-carboxamide,4-4,5-dihydroxy-9-methyl-3-oxo-1,3-dihydronaphtho 2,3-c furan-1-yl-3-dimethylamino-2,5-dihydroxy-6-oxocyclohex-1-ene-1-carboxamide,4-4,5-dihydroxy-9-methyl-3-oxohydrobenzo f isobenzofuranyl-3-dimethylamino-2,5-dihydroxy-6-oxocyclohex-1-enecarboxamide,4-4,5-dihydroxy-9-methyl-3-oxo-1h-naphtho 2,3-c furan-1-yl-3-dimethylamino-2,5-dihydroxy-6-oxocyclohex-1-ene-1-carboxamide PubChem CID: 54710410 IUPAC Name: 4-(4,5-dihydroxy-9-methyl-3-oxo-1H-benzo[f][2]benzofuran-1-yl)-3-(dimethylamino)-2,5-dihydroxy-6-oxocyclohexene-1-carboxamide SMILES: CC1=C2C(OC(=O)C2=C(C3=C1C=CC=C3O)O)C4C(C(=C(C(=O)C4O)C(=O)N)O)N(C)C

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Specifications

PubChem CID	54710410
CAS	18751-99-0
Molecular Weight (g/mol)	442.39
MDL Number	MFCD00062827
SMILES	CC1=C2C(OC(=O)C2=C(C3=C1C=CC=C3O)O)C4C(C(=C(C(=O)C4O)C(=O)N)O)N(C)C
Synonym	beta-apo-oxytetracycline,alpha-apo-oxytetracycline,alpha-apooxytetracycline,alpha-apoterramycin,beta-apo oxytetracycline,2z-2-amino hydroxy methylidene-5-4,5-dihydroxy-9-methyl-3-oxo-1h-benzo f 2 benzofuran-1-yl-4-dimethylamino-6-hydroxycyclohexane-1,3-dione,4-1,3-dihydro-4,5-dihydroxy-9-methyl-3-oxonaphtho 2,3-c furan-1-yl-3-dimethylamino-2,5-dihydroxy-6-oxo-1-cyclohexene-1-carboxamide,4-4,5-dihydroxy-9-methyl-3-oxo-1,3-dihydronaphtho 2,3-c furan-1-yl-3-dimethylamino-2,5-dihydroxy-6-oxocyclohex-1-ene-1-carboxamide,4-4,5-dihydroxy-9-methyl-3-oxohydrobenzo f isobenzofuranyl-3-dimethylamino-2,5-dihydroxy-6-oxocyclohex-1-enecarboxamide,4-4,5-dihydroxy-9-methyl-3-oxo-1h-naphtho 2,3-c furan-1-yl-3-dimethylamino-2,5-dihydroxy-6-oxocyclohex-1-ene-1-carboxamide
IUPAC Name	4-(4,5-dihydroxy-9-methyl-3-oxo-1H-benzo[f][2]benzofuran-1-yl)-3-(dimethylamino)-2,5-dihydroxy-6-oxocyclohexene-1-carboxamide
InChI Key	DRKMHDAKULCOKQ-UHFFFAOYSA-N
Molecular Formula	C₂₂H₂₂N₂O₈

300

Deoxyribonucleic acid sodium salt, calf thymus

CAS: 91080-16-9 MDL Number: MFCD00163436 IUPAC Name: Deoxyribonucleic acid sodium salt

Pricing & Availability
Specifications

CAS	91080-16-9
MDL Number	MFCD00163436
IUPAC Name	Deoxyribonucleic acid sodium salt

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