chempirical

Benzophenone

C13H10OCAS 119-61-9182.22 g/mol

Open in Covalent MOL file
O
Ketone

Properties

Molecular formula
C13H10O
Molar mass
182.22 g/mol
Exact mass
182.0732 Da
Density
1.1108 g/mL (at 18 °C)
Melting point
48.5 °C
Boiling point
305.4 °C
Water solubility
insoluble
logP
2.92Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

Danger
Health Hazard (GHS08)

Harmonised EU classification (CLP Annex VI), via PubChem.

Precautionary statements

P203, P280, P318, P405, P501

Identifiers

CAS number
119-61-9
SMILES
O=C(c1ccccc1)c1ccccc1
InChIKey
RWCCWEUUXYIKHB-UHFFFAOYSA-N
InChI
InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

28 names · show all
  • Methanone, diphenyl-
  • Diphenylmethanone
  • Benzene, benzoyl-
  • Benzoylbenzene
  • Diphenyl ketone
  • α-Oxodiphenylmethane
  • α-Oxoditane
  • Phenyl ketone
  • Adjutan 6016
  • Kayacure BP
  • Speedcure BP
  • Darocur BP
  • Lowlite 24
  • NSC 8077
  • Kayacure BP 100
  • BLS 531
  • Runtecure 1020
  • BP
  • Irgacure BP
  • Winure BP
  • JRCure 1020
  • Daracure 1137
  • Gencure BP
  • PI BP
  • Photoinitiator BP
  • Hycure benzophenone
  • B 0083
  • Omnirad BP

Reactions

Work with Benzophenone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,4-Dibenzoylbenzene3016-97-594 % similar 1,3,5-Tribenzoylbenzene25871-69-683 % similar 1,3-Dibenzoylbenzene3770-82-979 % similar 4-Phenylbenzophenone2128-93-075 % similar 1,2-Dibenzoylbenzene1159-86-074 % similar 4-Benzoylpyridine14548-46-071 % similar 4-Aminobenzophenone1137-41-368 % similar 4-Hydroxybenzophenone1137-42-468 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

[1,1′-Biphenyl]-2-carboxaldehyde1203-68-5 [1,1′-Biphenyl]-3-carboxaldehyde1204-60-0 Fluorenol1689-64-1 [1,1′-Biphenyl]-4-carboxaldehyde3218-36-8 Atractylodin55290-63-6 Xanthene92-83-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia