Unclassified Organic Compounds

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

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1,351 – 1,365 of 205,669 results

1,351

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Taurochenodeoxycholic Acid Sodium Salt, Spectrum™ Chemical

CAS: 6009-98-9 Molecular Formula: C26H44NNaO6S Molecular Weight (g/mol): 521.69 InChI Key: IYPNVUSIMGAJFC-UHFFFAOYNA-M IUPAC Name: sodium 2-(4-{4,7-dihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl}pentanamido)ethane-1-sulfonate SMILES: [Na+].CC(CCC(=O)NCCS([O-])(=O)=O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CCC12C

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CAS	6009-98-9
Molecular Weight (g/mol)	521.69
SMILES	[Na+].CC(CCC(=O)NCCS([O-])(=O)=O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CCC12C
IUPAC Name	sodium 2-(4-{4,7-dihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl}pentanamido)ethane-1-sulfonate
InChI Key	IYPNVUSIMGAJFC-UHFFFAOYNA-M
Molecular Formula	C26H44NNaO6S

1,352

8-benzyl-8-azabicyclo[3.2.1]octan-3-endo-ol, 95%, Thermo Scientific™

CAS: 18717-73-2 Molecular Formula: C14H19NO Molecular Weight (g/mol): 217.312 MDL Number: MFCD09966164 InChI Key: HCBGIBWAPOFRKI-PBWFPOADSA-N Synonym: n-benzylnortropine,1r,5s-8-benzyl-8-azabicyclo 3.2.1 octan-3-ol,endo-8-benzyl-8-azabicyclo 3.2.1 octan-3-ol,1s,5r-8-benzyl-8-azabicyclo 3.2.1 octan-3-ol,1r,3r,5s-8-benzyl-8-azabicyclo 3.2.1 octan-3-ol,1r,3s,5s-8-benzyl-8-azabicyclo 3.2.1 octan-3-ol PubChem CID: 14762744 IUPAC Name: (1R,5S)-8-benzyl-8-azabicyclo[3.2.1]octan-3-ol SMILES: C1CC2CC(CC1N2CC3=CC=CC=C3)O

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Specifications

PubChem CID	14762744
CAS	18717-73-2
Molecular Weight (g/mol)	217.312
MDL Number	MFCD09966164
SMILES	C1CC2CC(CC1N2CC3=CC=CC=C3)O
Synonym	n-benzylnortropine,1r,5s-8-benzyl-8-azabicyclo 3.2.1 octan-3-ol,endo-8-benzyl-8-azabicyclo 3.2.1 octan-3-ol,1s,5r-8-benzyl-8-azabicyclo 3.2.1 octan-3-ol,1r,3r,5s-8-benzyl-8-azabicyclo 3.2.1 octan-3-ol,1r,3s,5s-8-benzyl-8-azabicyclo 3.2.1 octan-3-ol
IUPAC Name	(1R,5S)-8-benzyl-8-azabicyclo[3.2.1]octan-3-ol
InChI Key	HCBGIBWAPOFRKI-PBWFPOADSA-N
Molecular Formula	C14H19NO

1,353

Cesium chloride, MP Biomedicals™

CAS: 7647-17-8 Molecular Formula: ClCs Molecular Weight (g/mol): 168.36 MDL Number: MFCD00010955 InChI Key: AIYUHDOJVYHVIT-UHFFFAOYSA-M IUPAC Name: caesium(1+) chloride SMILES: [Cl-].[Cs+]

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CAS	7647-17-8
Molecular Weight (g/mol)	168.36
MDL Number	MFCD00010955
SMILES	[Cl-].[Cs+]
IUPAC Name	caesium(1+) chloride
InChI Key	AIYUHDOJVYHVIT-UHFFFAOYSA-M
Molecular Formula	ClCs

1,354

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tert-Butyl (S)-5-oxopyrrolidine-2-carboxylate, 95%

CAS: 35418-16-7 Molecular Formula: C9H15NO3 Molecular Weight (g/mol): 185.223 MDL Number: MFCD06659481 InChI Key: QXGSPAGZWRTTOT-LURJTMIESA-N Synonym: s-tert-butyl 5-oxopyrrolidine-2-carboxylate,s-2-pyrrolidone-5-carboxylic acid t-butyl ester,tert-butyl 5-oxo-l-prolinate,l-pyroglutamic acid tert-butyl ester,tert-butyl s-2-pyrrolidone-5-carboxylate,tert-butyl l-pyroglutamate,tert-butyl 2s-5-oxopyrrolidine-2-carboxylate,s-5-oxo-pyrrolidine-2-carboxylic acid tert-butyl ester,l-pyroglutamicacidtert-butylester,tert-butyl s-5-oxopyrrolidine-2-carboxylate PubChem CID: 10888648 IUPAC Name: tert-butyl (2S)-5-oxopyrrolidine-2-carboxylate SMILES: CC(C)(C)OC(=O)C1CCC(=O)N1

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Specifications

PubChem CID	10888648
CAS	35418-16-7
Molecular Weight (g/mol)	185.223
MDL Number	MFCD06659481
SMILES	CC(C)(C)OC(=O)C1CCC(=O)N1
Synonym	s-tert-butyl 5-oxopyrrolidine-2-carboxylate,s-2-pyrrolidone-5-carboxylic acid t-butyl ester,tert-butyl 5-oxo-l-prolinate,l-pyroglutamic acid tert-butyl ester,tert-butyl s-2-pyrrolidone-5-carboxylate,tert-butyl l-pyroglutamate,tert-butyl 2s-5-oxopyrrolidine-2-carboxylate,s-5-oxo-pyrrolidine-2-carboxylic acid tert-butyl ester,l-pyroglutamicacidtert-butylester,tert-butyl s-5-oxopyrrolidine-2-carboxylate
IUPAC Name	tert-butyl (2S)-5-oxopyrrolidine-2-carboxylate
InChI Key	QXGSPAGZWRTTOT-LURJTMIESA-N
Molecular Formula	C9H15NO3

1,355

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Hydroxocobalamin, Spectrum™ Chemical

CAS: 13422-51-0

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Specifications

CAS	13422-51-0

1,356

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Methyl 3,4,5-trimethoxybenzoate, 98+%

CAS: 1916-07-0 Molecular Formula: C11H14O5 Molecular Weight (g/mol): 226.228 MDL Number: MFCD00008431 InChI Key: KACHFMOHOPLTNX-UHFFFAOYSA-N Synonym: trimethylgallic acid methyl ester,methyl tri-o-methylgallate,benzoic acid, 3,4,5-trimethoxy-, methyl ester,3,4,5-trimethoxybenzoic acid methyl ester,unii-qfp1lsc7tk,3,4,5-trimethoxybenzoic acid, methyl ester,qfp1lsc7tk,methyl3,4,5-trimethoxybenzoate,methyl 3,4,5-trimethoxy benzoate,acmc-209ev8 PubChem CID: 15956 IUPAC Name: methyl 3,4,5-trimethoxybenzoate SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)OC

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Specifications

PubChem CID	15956
CAS	1916-07-0
Molecular Weight (g/mol)	226.228
MDL Number	MFCD00008431
SMILES	COC1=CC(=CC(=C1OC)OC)C(=O)OC
Synonym	trimethylgallic acid methyl ester,methyl tri-o-methylgallate,benzoic acid, 3,4,5-trimethoxy-, methyl ester,3,4,5-trimethoxybenzoic acid methyl ester,unii-qfp1lsc7tk,3,4,5-trimethoxybenzoic acid, methyl ester,qfp1lsc7tk,methyl3,4,5-trimethoxybenzoate,methyl 3,4,5-trimethoxy benzoate,acmc-209ev8
IUPAC Name	methyl 3,4,5-trimethoxybenzoate
InChI Key	KACHFMOHOPLTNX-UHFFFAOYSA-N
Molecular Formula	C11H14O5

1,357

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4-(Dimethylamino)pyridine tribromide, 97%

CAS: 92976-81-3 Molecular Formula: C7H10Br3N2- Molecular Weight (g/mol): 361.883 MDL Number: MFCD00043439 InChI Key: TYDZHQMKSLAFKM-UHFFFAOYSA-N Synonym: 4-dimethylamino pyridine hydrobromide perbromide PubChem CID: 131863682 SMILES: CN(C)C1=CC=NC=C1.Br[Br-]Br

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Specifications

PubChem CID	131863682
CAS	92976-81-3
Molecular Weight (g/mol)	361.883
MDL Number	MFCD00043439
SMILES	CN(C)C1=CC=NC=C1.Br[Br-]Br
Synonym	4-dimethylamino pyridine hydrobromide perbromide
InChI Key	TYDZHQMKSLAFKM-UHFFFAOYSA-N
Molecular Formula	C7H10Br3N2-

1,358

Monensin sodium salt, 90%, Thermo Scientific Chemicals

CAS: 22373-78-0 Molecular Formula: C36H61NaO11 Molecular Weight (g/mol): 692.86 InChI Key: XOIQMTLWECTKJL-FBZUZRIGSA-M IUPAC Name: sodium (2S,3R,4S)-4-[(2S,5R,7S,8R,9S)-2-[(2S,2'R,3'S,5R,5'R)-2-ethyl-5'-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-3'-methyl-[2,2'-bioxolan]-5-yl]-9-hydroxy-2,8-dimethyl-1,6-dioxaspiro[4.5]decan-7-yl]-3-methoxy-2-methylpentanoate SMILES: [Na+].CC[C@]1(CC[C@@H](O1)[C@]1(C)CC[C@]2(C[C@H](O)[C@@H](C)[C@H](O2)[C@@H](C)[C@@H](OC)[C@H](C)C([O-])=O)O1)[C@@H]1O[C@H](C[C@@H]1C)[C@H]1O[C@@](O)(CO)[C@H](C)C[C@@H]1C

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Specifications

CAS	22373-78-0
Molecular Weight (g/mol)	692.86
SMILES	[Na+].CC[C@]1(CC[C@@H](O1)[C@]1(C)CC[C@]2(C[C@H](O)[C@@H](C)[C@H](O2)[C@@H](C)[C@@H](OC)[C@H](C)C([O-])=O)O1)[C@@H]1O[C@H](C[C@@H]1C)[C@H]1O[C@@](O)(CO)[C@H](C)C[C@@H]1C
IUPAC Name	sodium (2S,3R,4S)-4-[(2S,5R,7S,8R,9S)-2-[(2S,2'R,3'S,5R,5'R)-2-ethyl-5'-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-3'-methyl-[2,2'-bioxolan]-5-yl]-9-hydroxy-2,8-dimethyl-1,6-dioxaspiro[4.5]decan-7-yl]-3-methoxy-2-methylpentanoate
InChI Key	XOIQMTLWECTKJL-FBZUZRIGSA-M
Molecular Formula	C36H61NaO11

1,359

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Acetonyltriphenylphosphonium chloride, 99%

CAS: 1235-21-8 Molecular Formula: C21H20ClOP Molecular Weight (g/mol): 354.81 MDL Number: MFCD00011813 InChI Key: XAMZZEBAJZJERT-UHFFFAOYSA-M Synonym: acetonyltriphenylphosphonium chloride,2-oxopropyl triphenylphosphonium chloride,2-oxopropyltriphenylphosphonium chloride,phosphonium, acetonyltriphenyl-, chloride,acetonyl triphenylphosphonium chloride,phosphonium, 2-oxopropyl triphenyl-, chloride,acetonyltriphenylphosphoniumchloride,2-oxopropyl triphenylphosphanium chloride,1-triphenylphosphino acetone, chloride,acmc-1c01z PubChem CID: 196994 IUPAC Name: 2-oxopropyl(triphenyl)phosphanium;chloride SMILES: [Cl-].CC(=O)C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	196994
CAS	1235-21-8
Molecular Weight (g/mol)	354.81
MDL Number	MFCD00011813
SMILES	[Cl-].CC(=O)C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	acetonyltriphenylphosphonium chloride,2-oxopropyl triphenylphosphonium chloride,2-oxopropyltriphenylphosphonium chloride,phosphonium, acetonyltriphenyl-, chloride,acetonyl triphenylphosphonium chloride,phosphonium, 2-oxopropyl triphenyl-, chloride,acetonyltriphenylphosphoniumchloride,2-oxopropyl triphenylphosphanium chloride,1-triphenylphosphino acetone, chloride,acmc-1c01z
IUPAC Name	2-oxopropyl(triphenyl)phosphanium;chloride
InChI Key	XAMZZEBAJZJERT-UHFFFAOYSA-M
Molecular Formula	C21H20ClOP

1,360

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Zein, Spectrum™ Chemical

CAS: 9010-66-6

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Specifications

CAS	9010-66-6

1,361

DL-Ethionine, Approx. 99%, MP Biomedicals™

CAS: 67-21-0 Molecular Formula: C6H13NO2S Molecular Weight (g/mol): 163.24 MDL Number: MFCD00063102 InChI Key: GGLZPLKKBSSKCX-UHFFFAOYNA-N Synonym: dl-ethionine,s-ethylhomocysteine,aethionin,s-ethyl-dl-homocysteine,2-amino-4-ethylthio butyric acid,dl-homocysteine, s-ethyl,ethionine, dl,+--ethionine,homocysteine, s-ethyl,2-amino-4-ethylthio butanoic acid PubChem CID: 6205 ChEBI: CHEBI:68662 IUPAC Name: 2-amino-4-(ethylsulfanyl)butanoic acid SMILES: CCSCCC(N)C(O)=O

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Specifications

PubChem CID	6205
CAS	67-21-0
Molecular Weight (g/mol)	163.24
ChEBI	CHEBI:68662
MDL Number	MFCD00063102
SMILES	CCSCCC(N)C(O)=O
Synonym	dl-ethionine,s-ethylhomocysteine,aethionin,s-ethyl-dl-homocysteine,2-amino-4-ethylthio butyric acid,dl-homocysteine, s-ethyl,ethionine, dl,+--ethionine,homocysteine, s-ethyl,2-amino-4-ethylthio butanoic acid
IUPAC Name	2-amino-4-(ethylsulfanyl)butanoic acid
InChI Key	GGLZPLKKBSSKCX-UHFFFAOYNA-N
Molecular Formula	C6H13NO2S

1,362

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2-Amino-3-fluorobenzeneboronic acid pinacol ester, 96%

CAS: 1831130-33-6 Synonym: 2-fluoro-6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl aniline,2-amino-3-fluorophenylboronic acid pinacol ester,2-amino-3-fluorobenzeneboronic acid pinacol ester,2-fluoro-6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzenamine

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Specifications

CAS	1831130-33-6
Synonym	2-fluoro-6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl aniline,2-amino-3-fluorophenylboronic acid pinacol ester,2-amino-3-fluorobenzeneboronic acid pinacol ester,2-fluoro-6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzenamine

1,363

Trimethylsulfoxonium chloride, 97%

CAS: 5034-06-0 Molecular Formula: C₃H₉ClOS Molecular Weight (g/mol): 128.62 MDL Number: MFCD00011898 InChI Key: KQYWHJICYXXDSQ-UHFFFAOYSA-M Synonym: trimethylsulfoxonium chloride,trimethyloxosulfonium chloride,trimethylsulfonium chloride oxide,trimethyloxosulphonium chloride,sulfonium, trimethyl-, chloride, s-oxide,sulfoxonium, trimethyl-, chloride,sulfoxonium, trimethyl-, chloride 8ci,9ci,trimethyl oxo-??-sulfanylium chloride,c3h9os.cl,sulfoxonium, chloride PubChem CID: 197819 SMILES: C[S+](=O)(C)C.[Cl-]

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Specifications

PubChem CID	197819
CAS	5034-06-0
Molecular Weight (g/mol)	128.62
MDL Number	MFCD00011898
SMILES	C[S+](=O)(C)C.[Cl-]
Synonym	trimethylsulfoxonium chloride,trimethyloxosulfonium chloride,trimethylsulfonium chloride oxide,trimethyloxosulphonium chloride,sulfonium, trimethyl-, chloride, s-oxide,sulfoxonium, trimethyl-, chloride,sulfoxonium, trimethyl-, chloride 8ci,9ci,trimethyl oxo-??-sulfanylium chloride,c3h9os.cl,sulfoxonium, chloride
InChI Key	KQYWHJICYXXDSQ-UHFFFAOYSA-M
Molecular Formula	C₃H₉ClOS