Basic information
- CAS
7499-21-0- Standard SMILES
COc1ccccc1C(=O)c1c(C(=O)O)ccc2ccccc12- InChIKey
ALAUERBCZIZZMO-UHFFFAOYSA-N- Molecular formula
- C19H14O4
- Average molar mass
- 306.3 g/mol
- Monoisotopic mass
- 306.08920892
Names & identifiers
- Preferred name
- 1-(2-Methoxybenzoyl)naphthalene-2-carboxylic acid
- IUPAC
- 1-(2-methoxybenzoyl)naphthalene-2-carboxylic acid
Names & synonyms
7499-21-01-(2-methoxybenzoyl)naphthalene-2-carboxylic acidNSC407622CHEMBL478106DTXSID80324736NSC-407622
Database identifiers
- CAS
7499-21-0- PubChem CID
- 348352
- DTXSID
DTXSID80324736- ChEMBL
CHEMBL478106
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 447
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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