Basic information
- Standard SMILES
COC(=O)c1cccc(-c2c(C)cccc2C=O)c1- InChIKey
YTVILLPDYNPJPT-UHFFFAOYSA-N- Molecular formula
- C16H14O3
- Average molar mass
- 254.28 g/mol
Names & identifiers
- Preferred name
- Methyl 2'-formyl-6'-methylbiphenyl-3-carboxylate
- IUPAC
- methyl 3-(2-formyl-6-methylphenyl)benzoate
Names & synonyms
SCHEMBL1747243YTVILLPDYNPJPT-UHFFFAOYSA-Nmethyl 2'-formyl-6'-methylbiphenyl-3-carboxylate
Database identifiers
- PubChem CID
- 23083093
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 326
Related reactions
4 records
Compound notes
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