2-Bromo-5-methylthiazole

C₄H₄BrNSCAS 41731-23-1178.05 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₄BrNS
Molar mass: 178.05 g/mol
Exact mass: 176.9248 Da
logP: 2.21Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

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

41731-23-1

SMILES

CC1=CN=C(S1)Br

InChIKey

FJPZHYAYNAUKKA-UHFFFAOYSA-N

InChI

InChI=1S/C4H4BrNS/c1-3-2-6-4(5)7-3/h2H,1H3

Weigh it out

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

Names and synonyms

1 names

2-Bromo-5-methyl-1,3-thiazole

Work with 2-Bromo-5-methylthiazole

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

2,5-Dimethylthiazole4175-66-052 % similar 2,5-Dibromothiazole4175-78-452 % similar 2-Chloro-5-methylthiazole33342-65-348 % similar 2-Bromo-5-fomylthiazole464192-28-743 % similar 2-Bromo-5-hydroxymethylthiazole687636-93-743 % similar Methyl 2-bromothiazole-5-carboxylate54045-74-840 % similar 2-Bromo-5-nitrothiazole3034-48-839 % similar 2-Bromo-5-thiazolecarboxylic acid54045-76-039 % similar

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

Same formula

4-Bromo-2-methyl-1,3-thiazole298694-30-1 2-Bromo-4-methyl-1,3-thiazole7238-61-1

Elsewhere

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