(4-Bromo-1,3-thiazol-2-yl)methanol

C₄H₄BrNOSCAS 204513-31-5194.05 g/mol

Open in Covalent MOL file

Alcohol Aryl halide

Properties

Molecular formula: C₄H₄BrNOS
Molar mass: 194.05 g/mol
Exact mass: 192.9197 Da
logP: 1.40Crippen estimate
Polar surface area: 33.1 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

204513-31-5

SMILES

C1=C(N=C(S1)CO)Br

InChIKey

FLYOCGYCIHPZRF-UHFFFAOYSA-N

InChI

InChI=1S/C4H4BrNOS/c5-3-2-8-4(1-7)6-3/h2,7H,1H2

Weigh it out

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

Names and synonyms

1 names

(4-Bromo-thiazol-2-yl)-methanol

Work with (4-Bromo-1,3-thiazol-2-yl)methanol

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

2,4-Dibromothiazole4175-77-346 % similar 4-Bromo-2-methyl-1,3-thiazole298694-30-143 % similar 4-Bromo-1,3-thiazol-2-amine502145-18-843 % similar (6-Bromopyridin-2-yl)methanol33674-96-339 % similar 1,3-Thiazol-2-ylmethanol14542-12-239 % similar 2-(Dimethylaminomethyl)-4-thiazolemethanol78441-69-738 % similar (6-Bromo-pyridin-3-yl)-methanol122306-01-835 % similar (2-Bromopyridin-4-yl)methanol118289-16-034 % similar

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

Same formula

2-Bromo-4-hydroxymethylthiazole5198-86-7 2-Bromo-5-hydroxymethylthiazole687636-93-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook