L-Cysteic acid

C₃H₇NO₅SCAS 498-40-8169.15 g/mol

Open in Covalent MOL file

Carboxylic acid Primary amine Sulfonic acid

Properties

Molecular formula: C₃H₇NO₅S
Molar mass: 169.15 g/mol
Exact mass: 169.0045 Da
Melting point: 245 °C (decomposes)
logP: -1.71Crippen estimate
Polar surface area: 117.7 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 3
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

498-40-8

SMILES

N[C@@H](CS(=O)(=O)O)C(=O)O

InChIKey

XVOYSCVBGLVSOL-REOHCLBHSA-N

InChI

InChI=1S/C3H7NO5S/c4-2(3(5)6)1-10(7,8)9/h2H,1,4H2,(H,5,6)(H,7,8,9)/t2-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names

L-Alanine, 3-sulfo-
Alanine, 3-sulfo-, L-
3-Sulfo-L-alanine
Cysteinesulfonic acid
Cysteic acid
Cysteinesulfonate
NSC 254030
(2R)-2-Amino-3-sulfopropanoic acid

Work with L-Cysteic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(±)-Homocysteic acid504-33-668 % similar D-Serine312-84-550 % similar 2,3-Diaminopropionic acid4033-39-050 % similar 2,3-Diaminopropionic acid515-94-650 % similar Serine56-45-150 % similar Diaminopimelic acid583-93-750 % similar S-Methylcysteine1187-84-448 % similar (+)-α-Aminobutyric acid1492-24-648 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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