(S)-2-Methylcysteine hydrochloride

C₄H₁₀ClNO₂SCAS 151062-55-4171.64 g/mol

Open in Covalent MOL file

Carboxylic acid Primary amine Thiol

Properties

Molecular formula: C₄H₁₀ClNO₂S
Molar mass: 171.64 g/mol
Exact mass: 171.0121 Da
logP: 0.14Crippen estimate
Polar surface area: 63.3 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 2
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

151062-55-4

SMILES

C[C@@](CS)(C(=O)O)N.Cl

InChIKey

MAGCVRLGTQSVGF-PGMHMLKASA-N

InChI

InChI=1S/C4H9NO2S.ClH/c1-4(5,2-8)3(6)7;/h8H,2,5H2,1H3,(H,6,7);1H/t4-;/m1./s1

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Names and synonyms

1 names

(2S)-2-Amino-2-methyl-3-sulfanylpropanoic acid hydrochloride

Work with (S)-2-Methylcysteine hydrochloride

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

Dl-isovaline465-58-756 % similar 2-Methylserine5424-29-356 % similar Isovaline595-39-156 % similar Isovaline595-40-456 % similar (2R)-2-Amino-2-methyl-4-pentenoic acid96886-56-550 % similar Dl-α-methylphenylalanine1132-26-947 % similar α-Methyl-D-phenylalanine17350-84-447 % similar 1-Amino-1-cyclopropanecarboxylic acid hydrochloride68781-13-547 % similar

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

Same formula

3-Methanesulfonylazetidine hydrochloride1400764-60-4 (R)-2-Methylcysteine hydrochloride148766-37-4 Methyl cysteinate hydrochloride18598-63-5

Elsewhere

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