Basic information
- Standard SMILES
COC(OC)c1cccc(Br)c1C- InChIKey
SFUMHCUJLJZJBQ-UHFFFAOYSA-N- Molecular formula
- C10H13BrO2
- Average molar mass
- 245.11 g/mol
- Monoisotopic mass
- 244.00989
Names & identifiers
- Preferred name
- 1-Bromo-3-dimethoxymethyl-2-methyl-benzene
- IUPAC
- 1-bromo-3-(dimethoxymethyl)-2-methylbenzene
Names & synonyms
SCHEMBL5840772SFUMHCUJLJZJBQ-UHFFFAOYSA-N1-Bromo-3-dimethoxymethyl-2-methyl-benzene
Database identifiers
- PubChem CID
- 21886070
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 148
Related reactions
4 records
Compound notes
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