2-Bromo-4-hydroxymethylthiazole

C4H4BrNOSCAS 5198-86-7194.05 g/mol

Open in Covalent MOL file
NSBrOH
AlcoholAryl 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 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 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
5198-86-7
SMILES
C1=C(N=C(S1)Br)CO
InChIKey
FRPHIGOLOLSXAI-UHFFFAOYSA-N
InChI
InChI=1S/C4H4BrNOS/c5-4-6-3(1-7)2-8-4/h2,7H,1H2

Weigh it out

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Names and synonyms

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

Work with 2-Bromo-4-hydroxymethylthiazole

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 2-(Dimethylaminomethyl)-4-thiazolemethanol78441-69-746 % similar 2-Bromo-4-methyl-1,3-thiazole7238-61-143 % similar 2-Bromo-4-thiazolecarboxylic acid5198-88-940 % similar (6-Bromopyridin-2-yl)methanol33674-96-339 % similar 4-Hydroxymethylthiazole7036-04-639 % similar 2,6-Pyridinedimethanol1195-59-138 % similar 2-Hydroxymethyl-5-bromopyridine88139-91-735 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(4-Bromo-1,3-thiazol-2-yl)methanol204513-31-5 2-Bromo-5-hydroxymethylthiazole687636-93-7

Elsewhere

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