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Unclassified Organic Compounds

Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.
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1 – 15 of 20 results
1

Thermo Scientific Chemicals D(-)-Penicillamine, 99%, specified according to Ph.Eur. and USP

CAS: 52-67-5 Molecular Formula: C5H11NO2S Molecular Weight (g/mol): 149.21 MDL Number: MFCD00064302 InChI Key: VVNCNSJFMMFHPL-VKHMYHEASA-N Synonym: d-penicillamine,penicillamine,cuprimine,d---penicillamine,depen,3-mercapto-d-valine,cuprenil,d-penamine,--penicillamine,d-mercaptovaline PubChem CID: 5852 ChEBI: CHEBI:7959 IUPAC Name: (2S)-2-amino-3-methyl-3-sulfanylbutanoic acid SMILES: CC(C)(C(C(=O)O)N)S

PubChem CID 5852
CAS 52-67-5
Molecular Weight (g/mol) 149.21
ChEBI CHEBI:7959
MDL Number MFCD00064302
SMILES CC(C)(C(C(=O)O)N)S
Synonym d-penicillamine,penicillamine,cuprimine,d---penicillamine,depen,3-mercapto-d-valine,cuprenil,d-penamine,--penicillamine,d-mercaptovaline
IUPAC Name (2S)-2-amino-3-methyl-3-sulfanylbutanoic acid
InChI Key VVNCNSJFMMFHPL-VKHMYHEASA-N
Molecular Formula C5H11NO2S
2

Betaine hydrochloride, 99%, extra pure, specified according to the requirements of USP

CAS: 590-46-5 Molecular Formula: C5H12ClNO2 Molecular Weight (g/mol): 153.61 MDL Number: MFCD00011903 InChI Key: HOPSCVCBEOCPJZ-UHFFFAOYSA-N Synonym: betaine hydrochloride,betaine chloride,pluchine,acidogeno,acipepsol,achylin,acidin,acinorm,acidol,acidine PubChem CID: 11545 IUPAC Name: carboxymethyl(trimethyl)azanium;chloride SMILES: [Cl-].C[N+](C)(C)CC(O)=O

PubChem CID 11545
CAS 590-46-5
Molecular Weight (g/mol) 153.61
MDL Number MFCD00011903
SMILES [Cl-].C[N+](C)(C)CC(O)=O
Synonym betaine hydrochloride,betaine chloride,pluchine,acidogeno,acipepsol,achylin,acidin,acinorm,acidol,acidine
IUPAC Name carboxymethyl(trimethyl)azanium;chloride
InChI Key HOPSCVCBEOCPJZ-UHFFFAOYSA-N
Molecular Formula C5H12ClNO2
4

Tyloxapol, USP, Spectrum™ Chemical

CAS: 25301-02-4 Molecular Formula: C17H28O3 Molecular Weight (g/mol): 280.41 InChI Key: MDYZKJNTKZIUSK-UHFFFAOYSA-N IUPAC Name: 4-(2,4,4-trimethylpentan-2-yl)phenol; formaldehyde; oxirane SMILES: C=O.C1CO1.CC(C)(C)CC(C)(C)C1=CC=C(O)C=C1

CAS 25301-02-4
Molecular Weight (g/mol) 280.41
SMILES C=O.C1CO1.CC(C)(C)CC(C)(C)C1=CC=C(O)C=C1
IUPAC Name 4-(2,4,4-trimethylpentan-2-yl)phenol; formaldehyde; oxirane
InChI Key MDYZKJNTKZIUSK-UHFFFAOYSA-N
Molecular Formula C17H28O3
7

Serine, USP, 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

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
8

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

CAS: 58-86-6 Molecular Formula: C5H10O5 Molecular Weight (g/mol): 150.13 InChI Key: SRBFZHDQGSBBOR-UHFFFAOYNA-N IUPAC Name: oxane-2,3,4,5-tetrol SMILES: OC1COC(O)C(O)C1O

CAS 58-86-6
Molecular Weight (g/mol) 150.13
SMILES OC1COC(O)C(O)C1O
IUPAC Name oxane-2,3,4,5-tetrol
InChI Key SRBFZHDQGSBBOR-UHFFFAOYNA-N
Molecular Formula C5H10O5
9

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

CAS: 58-86-6 Molecular Formula: C5H10O5 Molecular Weight (g/mol): 150.13 InChI Key: SRBFZHDQGSBBOR-UHFFFAOYNA-N IUPAC Name: oxane-2,3,4,5-tetrol SMILES: OC1COC(O)C(O)C1O

CAS 58-86-6
Molecular Weight (g/mol) 150.13
SMILES OC1COC(O)C(O)C1O
IUPAC Name oxane-2,3,4,5-tetrol
InChI Key SRBFZHDQGSBBOR-UHFFFAOYNA-N
Molecular Formula C5H10O5
10

Methionine, USP, 98.5-101.5%, Spectrum™ Chemical

CAS: 63-68-3 Molecular Formula: C5H11NO2S Molecular Weight (g/mol): 149.21 MDL Number: MFCD00063097 MFCD00801344 InChI Key: FFEARJCKVFRZRR-BYPYZUCNSA-N IUPAC Name: (2S)-2-amino-4-(methylsulfanyl)butanoic acid SMILES: CSCC[C@H](N)C(O)=O

CAS 63-68-3
Molecular Weight (g/mol) 149.21
MDL Number MFCD00063097 MFCD00801344
SMILES CSCC[C@H](N)C(O)=O
IUPAC Name (2S)-2-amino-4-(methylsulfanyl)butanoic acid
InChI Key FFEARJCKVFRZRR-BYPYZUCNSA-N
Molecular Formula C5H11NO2S
11

Hydroxocobalamin, USP, 95-102%, Spectrum™ Chemical

CAS: 13422-51-0 Molecular Formula: C62H90CoN13O15P Molecular Weight (g/mol): 1347.39 InChI Key: PJOHJFIDLYDPIZ-PMEYKKDOSA-M IUPAC Name: λ²-cobalt(2+) (2R,3S,4S,6Z,8S,9S,11Z,14S,16Z,18R,19R)-4,9,14-tris(2-carbamoylethyl)-3,8,19-tris(carbamoylmethyl)-18-(2-{[(2S)-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 λ³-oxidanide SMILES: [OH2-].[Co++].C[C@@H](CNC(=O)CC[C@]1(C)[C@@H](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)[C@@H]1CCC(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

CAS 13422-51-0
Molecular Weight (g/mol) 1347.39
SMILES [OH2-].[Co++].C[C@@H](CNC(=O)CC[C@]1(C)[C@@H](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)[C@@H]1CCC(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
IUPAC Name λ²-cobalt(2+) (2R,3S,4S,6Z,8S,9S,11Z,14S,16Z,18R,19R)-4,9,14-tris(2-carbamoylethyl)-3,8,19-tris(carbamoylmethyl)-18-(2-{[(2S)-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 λ³-oxidanide
InChI Key PJOHJFIDLYDPIZ-PMEYKKDOSA-M
Molecular Formula C62H90CoN13O15P
15

Betaine Hydrochloride, USP, 98-100.5%, Spectrum™ Chemical

CAS: 590-46-5 Molecular Formula: C5H12ClNO2 Molecular Weight (g/mol): 153.61 MDL Number: MFCD00011903 InChI Key: HOPSCVCBEOCPJZ-UHFFFAOYSA-N IUPAC Name: (carboxymethyl)trimethylazanium chloride SMILES: [Cl-].C[N+](C)(C)CC(O)=O

CAS 590-46-5
Molecular Weight (g/mol) 153.61
MDL Number MFCD00011903
SMILES [Cl-].C[N+](C)(C)CC(O)=O
IUPAC Name (carboxymethyl)trimethylazanium chloride
InChI Key HOPSCVCBEOCPJZ-UHFFFAOYSA-N
Molecular Formula C5H12ClNO2