2-(4-Methylnaphthalene-1-carbonyl)benzoic acid
Basic information
- CAS
35187-29-2- Standard SMILES
Cc1ccc(C(=O)c2ccccc2C(=O)O)c2ccccc12- InChIKey
ILZBGGYAYBHVGB-UHFFFAOYSA-N- Molecular formula
- C19H14O3
- Average molar mass
- 290.3 g/mol
- Monoisotopic mass
- 290.0942943
Names & identifiers
- Preferred name
- 2-(4-Methylnaphthalene-1-carbonyl)benzoic acid
- IUPAC
- 2-(4-methylnaphthalene-1-carbonyl)benzoic acid
Names & synonyms
35187-29-22-(4-methylnaphthalene-1-carbonyl)benzoic acidDTXSID70325257RefChem:252629DTXCID502763742-(4-Methyl-1-naphthoyl)benzoic AcidNSC409469SCHEMBL14124749NSC-409469
Database identifiers
- CAS
35187-29-2- PubChem CID
- 349635
- DTXSID
DTXSID70325257
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
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Compound notes
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