Basic information
- Standard SMILES
COc1c(Cl)ccc(Br)c1F- InChIKey
LFXNZQWUCRMXHN-UHFFFAOYSA-N- Molecular formula
- C7H5BrClFO
- Average molar mass
- 239.47 g/mol
- Monoisotopic mass
- 237.91963
Names & identifiers
- Preferred name
- 1-Bromo-4-chloro-2-fluoro-3-methoxybenzene
- IUPAC
- 1-bromo-4-chloro-2-fluoro-3-methoxybenzene
Names & synonyms
1-bromo-4-chloro-2-fluoro-3-methoxybenzene943832-96-0MFCD28401123SCHEMBL116147LFXNZQWUCRMXHN-UHFFFAOYSA-NDB-162445CS-01952891-bromo-4-chloro-2-fluoro-3-methoxy-benzeneE93525F632589
Database identifiers
- PubChem CID
- 66600367
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 136
Related reactions
25 records
Compound notes
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