1-(3-Methylbenzoyl)naphthalene-2-carboxylic acid
Basic information
- CAS
69653-20-9- Standard SMILES
Cc1cccc(C(=O)c2c(C(=O)O)ccc3ccccc23)c1- InChIKey
AJMJOCKPCNDMFV-UHFFFAOYSA-N- Molecular formula
- C19H14O3
- Average molar mass
- 290.3 g/mol
- Monoisotopic mass
- 290.0942943
Names & identifiers
- Preferred name
- 1-(3-Methylbenzoyl)naphthalene-2-carboxylic acid
- IUPAC
- 1-(3-methylbenzoyl)naphthalene-2-carboxylic acid
Names & synonyms
69653-20-91-(3-methylbenzoyl)naphthalene-2-carboxylic acid2-Naphthalenecarboxylicacid, 1-(3-methylbenzoyl)-NSC409468DTXSID10325256NSC-409468
Database identifiers
- CAS
69653-20-9- PubChem CID
- 349634
- DTXSID
DTXSID10325256
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 430
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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