Cysteine hydrochloride monohydrate

C₃H₁₀ClNO₃SCAS 7048-04-6175.63 g/mol

Open in Covalent MOL file

Carboxylic acid Primary amine Thiol

Properties

Molecular formula: C₃H₁₀ClNO₃S
Molar mass: 175.63 g/mol
Exact mass: 175.0070 Da
Density: 1.51 g/mL
logP: -1.07Crippen estimate
Polar surface area: 94.8 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 2
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

7048-04-6

SMILES

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

InChIKey

QIJRTFXNRTXDIP-JIZZDEOASA-N

InChI

InChI=1S/C3H7NO2S.ClH.H2O/c4-2(1-7)3(5)6;;/h2,7H,1,4H2,(H,5,6);1H;1H2/t2-;;/m0../s1

Weigh it out

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

Names and synonyms

5 names

L-Cysteine, hydrochloride, monohydrate
L-Cysteine, hydrochloride, hydrate (1:1:1)
Cysteine, hydrochloride, monohydrate, L-
Cysteine monohydrate hydrochloride
Cysteine hydrochloride

Work with Cysteine hydrochloride monohydrate

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

(±)-Cysteine hydrochloride10318-18-089 % similar (S)-2-Amino-3-mercaptopropanoic acid hydrochloride32443-99-589 % similar L-(+)-Cysteine hydrochloride52-89-189 % similar Cysteine3374-22-978 % similar Cysteine52-90-478 % similar D-Cysteine921-01-778 % similar DL-2,3-Diaminopropionic acid hydrochloride54897-59-556 % similar DL-2,3-Diaminopropionic acid hydrochloride6018-55-956 % similar

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

Same formula

Dl-cysteine hydrochloride monohydrate116797-51-4

Elsewhere

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