Basic information
- Standard SMILES
COCOc1c(Br)cccc1C=O- InChIKey
HJYHLYNCSKHIIP-UHFFFAOYSA-N- Molecular formula
- C9H9BrO3
- Average molar mass
- 245.07 g/mol
- Monoisotopic mass
- 243.97351
Names & identifiers
- Preferred name
- 3-Bromo-2-(methoxymethoxy)benzaldehyde
- IUPAC
- 3-bromo-2-(methoxymethoxy)benzaldehyde
Names & synonyms
3-bromo-2-(methoxymethoxy)benzaldehyde236094-18-1SCHEMBL1806253SCHEMBL29940732HJYHLYNCSKHIIP-UHFFFAOYSA-NMFCD21195363AKOS014700095G73410F983481
Database identifiers
- PubChem CID
- 11368564
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 163
Related reactions
1 records
Compound notes
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