chempirical

Mexenone

C15H14O3CAS 1641-17-4242.27 g/mol

Open in Covalent MOL file
OOOH
EtherKetonePhenol

Properties

Molecular formula
C15H14O3
Molar mass
242.27 g/mol
Exact mass
242.0943 Da
Melting point
95 °C
logP
2.94Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, P501

Identifiers

CAS number
1641-17-4
SMILES
COc1ccc(C(=O)c2ccc(C)cc2)c(O)c1
InChIKey
MJVGBKJNTFCUJM-UHFFFAOYSA-N
InChI
InChI=1S/C15H14O3/c1-10-3-5-11(6-4-10)15(17)13-8-7-12(18-2)9-14(13)16/h3-9,16H,1-2H3

Weigh it out

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Names and synonyms

10 names
  • Methanone, (2-hydroxy-4-methoxyphenyl)(4-methylphenyl)-
  • Benzophenone, 2-hydroxy-4-methoxy-4′-methyl-
  • (2-Hydroxy-4-methoxyphenyl)(4-methylphenyl)methanone
  • 2-Hydroxy-4-methoxy-4′-methylbenzophenone
  • Benzophenone 10
  • Mexenon
  • Uvistat 2211
  • Uvistat
  • (2-Hydroxy-4-methoxyphenyl)(p-tolyl)methanone
  • 2-Hydroxy-4-methoxy-4'-methylbenzophenone

Work with Mexenone

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Oxybenzone131-57-775 % similar 2,2′-Dihydroxy-4,4′-dimethoxybenzophenone131-54-473 % similar Dioxybenzone131-53-364 % similar 4-Methoxysalicylic acid2237-36-759 % similar 2,4-Dimethoxy-4'-hydroxybenzophenone41351-30-858 % similar Paeonol552-41-057 % similar Methyl 4-methoxysalicylate5446-02-656 % similar 2-Hydroxy-4-methoxybenzamide6745-77-356 % similar

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

Same formula

2-(Benzyloxy)phenylacetic acid22047-88-7 4-(Benzyloxy)-3-methoxybenzaldehyde2426-87-1 4'-Benzyloxy-2'-hydroxyacetophenone29682-12-0 1-(5-(Benzyloxy)-2-hydroxyphenyl)ethanone30992-63-3 Fenoprofen31879-05-7 Methyl 4-benzyloxybenzoate32122-11-5 4-Methoxyresveratrol33626-08-3 Bis(phenylmethyl) carbonate3459-92-5

Elsewhere

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