chempirical

2,2′,4,4′,6,6′-Hexamethylbenzophenone

C19H22OCAS 5623-45-0266.38 g/mol

Open in Covalent MOL file
O
Ketone

Properties

Molecular formula
C19H22O
Molar mass
266.38 g/mol
Exact mass
266.1671 Da
Melting point
136–137 °C
Boiling point
200 °C
logP
4.77Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
5623-45-0
SMILES
Cc1cc(C)c(C(=O)c2c(C)cc(C)cc2C)c(C)c1
InChIKey
SKMUIZHHMAPKIV-UHFFFAOYSA-N
InChI
InChI=1S/C19H22O/c1-11-7-13(3)17(14(4)8-11)19(20)18-15(5)9-12(2)10-16(18)6/h7-10H,1-6H3

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Names and synonyms

8 names
  • 2,2',4,4',6,6'-Hexamethylbenzophenone
  • Dimesityl ketone
  • Methanone, bis(2,4,6-trimethylphenyl)-
  • Benzophenone, 2,2′,4,4′,6,6′-hexamethyl-
  • Bis(2,4,6-trimethylphenyl)methanone
  • Mesityl ketone
  • 2,4,6,2′,4′,6′-Hexamethylbenzophenone
  • Bis(2,4,6-trimethylphenyl) ketone

Work with 2,2′,4,4′,6,6′-Hexamethylbenzophenone

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

2,4,6-Trimethylbenzophenone954-16-568 % similar 2′,4′,6′-Trimethylacetophenone1667-01-262 % similar 2′,4′,6′-Trimethylacetophenone51885-97-362 % similar 2,4,6-Trimethylbenzoic acid480-63-759 % similar 2,4,6-Trimethylbenzoyl chloride938-18-159 % similar Methyl 2,4,6-trimethylbenzoate2282-84-055 % similar Ethyl 2,4,6-trimethylbenzoate1754-55-850 % similar Solvent blue 104116-75-646 % similar

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

Elsewhere

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