Basic information
- Standard SMILES
COCc1ncc(Br)n1C- InChIKey
VONDZVHTFIQUHI-UHFFFAOYSA-N- Molecular formula
- C6H9BrN2O
- Average molar mass
- 205.05 g/mol
- Monoisotopic mass
- 203.98983
Names & identifiers
- Preferred name
- 5-Bromo-2-(methoxymethyl)-1-methyl-1H-imidazole
- IUPAC
- 5-bromo-2-(methoxymethyl)-1-methylimidazole
Names & synonyms
5-Bromo-2-(methoxymethyl)-1-methyl-1H-imidazoleSCHEMBL15507196VONDZVHTFIQUHI-UHFFFAOYSA-NDB-1683801578484-63-5
Database identifiers
- PubChem CID
- 89995601
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 27.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 112
Related reactions
1 records
Compound notes
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