2-(2-Aminothiazol-4-yl) acetic acid hydrochloride

C5H7ClN2O2SCAS 66659-20-9194.63 g/mol

Open in Covalent MOL file
NSH2NOOHHCl
Carboxylic acidPrimary amine

Properties

Molecular formula
C5H7ClN2O2S
Molar mass
194.63 g/mol
Exact mass
193.9917 Da
logP
0.77Crippen estimate
Polar surface area
76.2 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 4 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
66659-20-9
SMILES
C1=C(N=C(S1)N)CC(=O)O.Cl
InChIKey
ZEWJJZKVQOMYKJ-UHFFFAOYSA-N
InChI
InChI=1S/C5H6N2O2S.ClH/c6-5-7-3(2-10-5)1-4(8)9;/h2H,1H2,(H2,6,7)(H,8,9);1H

Weigh it out

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

Work with 2-(2-Aminothiazol-4-yl) acetic acid 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

Methyl 2-amino-4-thiazoleacetate64987-16-252 % similar (2-Phenyl-thiazol-4-yl)-acetic acid16441-28-451 % similar 2-(Formylamino)-4-thiazoleacetic acid75890-68-550 % similar 2-Pyridylacetic acid hydrochloride16179-97-845 % similar 2-Aminothiazole-4-carboxylic acid40283-41-845 % similar (Z)-2-(2-Aminothiazol-4-yl)-2-carboxymethoxyiminoacetic acid74440-05-443 % similar 4-Pyridineacetic acid hydrochloride6622-91-941 % similar Glycine hydrochloride6000-43-739 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,2-Dimethyl-1H-imidazole-4-sulfonyl chloride137049-02-6

Elsewhere

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