4-Bromo-1-methyl-1H-imidazole-5-carbaldehyde

C5H5BrN2OCAS 141524-74-5189.01 g/mol

NNBrO
AldehydeAryl halide

Properties

Molecular formula
C5H5BrN2O
Molar mass
189.01 g/mol
Exact mass
187.9585 Da
logP
1.00Crippen estimate
Polar surface area
34.9 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
141524-74-5
SMILES
Cn1cnc(Br)c1C=O
InChIKey
MBLIXONXVCDFMO-UHFFFAOYSA-N
InChI
InChI=1S/C5H5BrN2O/c1-8-3-7-5(6)4(8)2-9/h2-3H,1H3

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Names and synonyms

3 names
  • 4-Bromo-1-methyl-1H-imidazole-5-carboxaldehyde
  • 1H-Imidazole-5-carboxaldehyde, 4-bromo-1-methyl-
  • 4-Bromo-1-methylimidazole-5-carboxaldehyde

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Similar compounds

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

Same formula

Elsewhere