Basic information
- CAS
116496-27-6- Standard SMILES
COc1cc(OC)cc(C(=O)c2ccc(OC)c(OC)c2)c1- InChIKey
CDGJPOYKKKNYQP-UHFFFAOYSA-N- Molecular formula
- C17H18O5
- Average molar mass
- 302.32 g/mol
- Monoisotopic mass
- 302.11542368
Names & identifiers
- Preferred name
- (3,4-Dimethoxyphenyl)(3,5-dimethoxyphenyl)methanone
- IUPAC
- (3,4-dimethoxyphenyl)-(3,5-dimethoxyphenyl)methanone
Names & synonyms
116496-27-6(3,4-Dimethoxyphenyl)(3,5-dimethoxyphenyl)methanone3,4,3',5'-Tetramethoxybenzophenone(3,4-dimethoxyphenyl)-(3,5-dimethoxyphenyl)methanoneSCHEMBL4824025DTXSID20616127CDGJPOYKKKNYQP-UHFFFAOYSA-N(3,4-dimethoxy-phenyl)-(3,5-dimethoxy-phenyl)-methanone
Database identifiers
- CAS
116496-27-6- PubChem CID
- 21584591
- DTXSID
DTXSID20616127
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 347
Related reactions
21 records
Compound notes
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