chempirical

4,4′-Dimethoxybenzil

C16H14O4CAS 1226-42-2270.28 g/mol

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EtherKetone

Properties

Molecular formula
C16H14O4
Molar mass
270.28 g/mol
Exact mass
270.0892 Da
Melting point
61.8 °C
Boiling point
195 °C (at 16 Torr)
logP
2.77Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
5

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P264+P265, P280, P305+P351+P338, P337+P317

Identifiers

CAS number
1226-42-2
SMILES
COc1ccc(C(=O)C(=O)c2ccc(OC)cc2)cc1
InChIKey
YNANGXWUZWWFKX-UHFFFAOYSA-N
InChI
InChI=1S/C16H14O4/c1-19-13-7-3-11(4-8-13)15(17)16(18)12-5-9-14(20-2)10-6-12/h3-10H,1-2H3

Weigh it out

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

Names and synonyms

16 names · show all
  • 4,4'-Dimethoxybenzil
  • 1,2-Ethanedione, 1,2-bis(4-methoxyphenyl)-
  • p-Anisil
  • Ethanedione, bis(4-methoxyphenyl)-
  • Anisil
  • 1,2-Bis(4-methoxyphenyl)-1,2-ethanedione
  • Bis(p-methoxyphenyl)ethanedione
  • Bis(4-methoxyphenyl)ethanedione
  • Di-p-anisylethanedione
  • p,p′-Dimethoxybenzil
  • NSC 19218
  • NSC 602910
  • 4,4′-Dimethoxylbenzil
  • 1,2-Bis(4-methoxyphenyl)ethanedione
  • 1,2-Bis(p-methoxyphenyl)ethane-1,2-dione
  • 1,2-Bis(4-methoxyphenyl)ethan-1,2-dione

Work with 4,4′-Dimethoxybenzil

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

4,4′-Dimethoxybenzophenone90-96-068 % similar Acetanisole100-06-163 % similar 4-Methoxybenzamide3424-93-963 % similar p-Anisic anhydride794-94-563 % similar Ethyl 2-(4-methoxyphenyl)-2-oxoacetate40140-16-763 % similar 4-Methoxybenzoyl chloride100-07-261 % similar p-Anisic acid100-09-461 % similar Methyl anisate121-98-261 % similar

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

Same formula

Cardamomin19309-14-9 1-(Phenylmethyl) 2-phenylpropanedioate25774-02-1 3,3'-Dimethoxy-[1,1'-biphenyl]-4,4'-dicarbaldehyde27343-98-2 Medicarpin32383-76-9 4,4'-Diacetoxybiphenyl32604-29-8 Echinatin34221-41-5 Alpinetin36052-37-6 (-)-Pinostrobin480-37-5

Elsewhere

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