Completing data — usually done within a minute
Basic information
- CAS
42797-21-7- Standard SMILES
O=C(O)c1ccccc1C(=O)c1ccc(Oc2ccccc2)cc1- InChIKey
DIGYASCXPKODLJ-UHFFFAOYSA-N- Molecular formula
- C20H14O4
- Average molar mass
- 318.3 g/mol
- Monoisotopic mass
- 318.08920893
Names & identifiers
- Preferred name
- 2-(4-Phenoxybenzoyl)benzoic acid
- IUPAC
- 2-(4-phenoxybenzoyl)benzoic acid
Names & synonyms
2-(4-phenoxybenzoyl)benzoic acid42797-21-7DTXSID90353613RefChem:252795DTXCID00304676Benzoic acid, 2-(4-phenoxybenzoyl)-Oprea1_707587MLS000705192SCHEMBL1443484CHEMBL1340174DIGYASCXPKODLJ-UHFFFAOYSA-N2-(p-phenoxybenzoyl) benzoic acid
Show more names
o-(4'-phenoxybenzoyl)benzoic acidAKOS001483286CCG-103172SMR000230851AG-690/36482010
Database identifiers
- CAS
42797-21-7- PubChem CID
- 746519
- DTXSID
DTXSID90353613- ChEMBL
CHEMBL1340174- Nikkaji
- J752.863I
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 433
Related reactions
3 records
Compound notes
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