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Basic information
- Standard SMILES
COC(OC)c1cc(C)cc(CBr)c1- InChIKey
GKOGFJRXCUTTHE-UHFFFAOYSA-N- Molecular formula
- C11H15BrO2
- Average molar mass
- 259.14 g/mol
Names & identifiers
- Preferred name
- 1-Bromomethyl-3-dimethoxymethyl-5-methyl-benzene
- IUPAC
- 1-(bromomethyl)-3-(dimethoxymethyl)-5-methylbenzene
Names & synonyms
SCHEMBL501437GKOGFJRXCUTTHE-UHFFFAOYSA-NDB-1027861-Bromomethyl-3-dimethoxymethyl-5-methyl-benzene1006301-08-1
Database identifiers
- PubChem CID
- 59184875
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 159
Related reactions
3 records
Compound notes
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