Molecular properties
- Formula
- C13H10O
- Molar mass
- 182.22 g·mol−1
- Exact mass
- 182.0732 Da
- 9
- 0
- 1
- 17.10 Ų
- 3.4 (PubChem computed XLogP3-AA descriptor)
- CAS
- 119-61-9
- PubChem CID
- 3102
Molecule record
BENZOPHENONE
C13H10O
182.22 g/mol
Interactions
- Polarity
- Often polar; exact polarity depends on size, substitution, and ionization state.
- Acid-base behavior
- Review ionizable groups and pKa data where available; ChemForge does not infer definitive acid-base state from identity alone.
- Intermolecular forces
- Assess dispersion, dipole interactions, hydrogen bonding, and ionic character from the functional groups shown.
Functional groups
Alkene
Aromatic ring
Phenol
Physical properties
| Property | Value | Conditions | Source |
|---|---|---|---|
| Logp | 3.4 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- 119-61-9
- 701M4TTV9O
- AI3-00754
- Adjutan 6016
- Benzene, benzoyl-
- Benzoylbenzene
- CCRIS 629
- CHEBI:41308
Show all 22 synonyms
- Caswell No. 081G
- DTXSID0021961
- Diphenyl ketone
- Diphenylketone
- EPA Pesticide Chemical Code 000315
- FEMA No. 2134
- Kayacure bp
- Ketone, diphenyl
- Methanone, diphenyl-
- NSC 8077
- Phenyl ketone
- alpha-Oxodiphenylmethane
- alpha-Oxoditane
- diphenylmethanone
Structure identifiers
- Canonical SMILES
- C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
- Isomeric SMILES
- C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
- InChI
- InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
- InChIKey
- RWCCWEUUXYIKHB-UHFFFAOYSA-N
- PubChem CID
- 3102
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
Simulated FTIR trace
Predicted FTIR / %T
4 cm-1 resolution / deterministic instrument profile
Hover for cursor
Peak assignments
3350 cm−1broad O-H (simulated)
1645 cm−1C=C alkene (simulated)
3030 cm−1aromatic C-H (simulated)
1600 cm−1aromatic C=C (simulated)
2960 cm−1sp3 C-H (simulated)
Simulated NMR
On-demand educational prediction for BENZOPHENONE; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for BENZOPHENONE; not experimental data.
Sources
Molecule identity
Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.
simulated IR
ChemForge original educational simulation.