Cysteine hydrochloride monohydrate

C3H10ClNO3SCAS 7048-04-6175.63 g/mol

Open in Covalent MOL file
HClNH2HSOOHH2O
Carboxylic acidPrimary amineThiol

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 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
2
Stereocentres
Rin SMILES atom order

Hazards

Warning
Irritant (GHS07)

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

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

6 names
  • L-Cysteine, hydrochloride, monohydrate
  • L-Cysteine, hydrochloride, hydrate (1:1:1)
  • Cysteine, hydrochloride, monohydrate, L-
  • Cysteine monohydrate hydrochloride
  • Cysteine hydrochloride
  • L-Cysteine hydrochloride monohydrate

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

L-(+)-Cysteine hydrochloride52-89-1Anhydrous (±)-Cysteine hydrochloride10318-18-0Anhydrous, stereo not defined D-Cysteine hydrochloride32443-99-5Anhydrous, enantiomer Cysteine52-90-4Free base D-Cysteine921-01-7Free base, enantiomer Cysteine3374-22-9Free base, stereo not defined DL-cysteine hydrochloride hydrate96998-61-7Stereo not defined Dl-cysteine hydrochloride monohydrate116797-51-4Stereo not defined

Similar compounds

(S)-(+)-2,3-Diaminopropionic acid hydrochloride1482-97-956 % similar DL-2,3-Diaminopropionic acid hydrochloride54897-59-556 % similar DL-2,3-Diaminopropionic acid hydrochloride6018-55-956 % similar (R)-(-)-2,3-Diaminopropionic acid hydrochloride6018-56-056 % similar Cystine dihydrochloride30925-07-655 % similar L-Cystine, hydrochloride (1:?)34760-60-655 % similar 3-Chloro-L-alanine hydrochloride51887-89-955 % similar (s)-2-Aminobutanoic acid hydrochloride5959-29-555 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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