Basic information
- CAS
327163-78-0- Standard SMILES
COc1ccc(O)c(C=O)c1Br- InChIKey
OIPYMMRATVNCBB-UHFFFAOYSA-N- Molecular formula
- C8H7BrO3
- Average molar mass
- 231.04 g/mol
- Monoisotopic mass
- 229.95786
Names & identifiers
- Preferred name
- 2-Bromo-6-hydroxy-3-methoxybenzaldehyde
- IUPAC
- 2-bromo-6-hydroxy-3-methoxybenzaldehyde
Names & synonyms
327163-78-02-Bromo-6-hydroxy-3-methoxybenzaldehydeSCHEMBL31094206DTXSID501277958Benzaldehyde, 2-bromo-6-hydroxy-3-methoxy-
Database identifiers
- CAS
327163-78-0- PubChem CID
- 10681007
- DTXSID
DTXSID501277958
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…