Basic information
- CAS
179308-40-8- Standard SMILES
COc1ccc(C)cc1Cc1ccccc1- InChIKey
ODNXHKMSRCTHII-UHFFFAOYSA-N- Molecular formula
- C15H16O
- Average molar mass
- 212.29 g/mol
- Monoisotopic mass
- 212.12011513
Names & identifiers
- Preferred name
- 2-Benzyl-1-methoxy-4-methylbenzene
- IUPAC
- 2-benzyl-1-methoxy-4-methylbenzene
Names & synonyms
2-Benzyl-1-methoxy-4-methylbenzene179308-40-8DTXSID10608571RefChem:256515DTXCID20559328Benzene, 1-methoxy-4-methyl-2-(phenylmethyl)-2-benyl-4-methylanisoleSCHEMBL3958050ODNXHKMSRCTHII-UHFFFAOYSA-N
Database identifiers
- CAS
179308-40-8- PubChem CID
- 20549031
- DTXSID
DTXSID10608571- Nikkaji
- J2.869.573J
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 196
Related reactions
2 records
Compound notes
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