chempirical

Hydroquinone dibenzyl ether

C20H18O2CAS 621-91-0290.36 g/mol

Open in Covalent MOL file
OO
Ether

Properties

Molecular formula
C20H18O2
Molar mass
290.36 g/mol
Exact mass
290.1307 Da
Melting point
128 °C
logP
4.84Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
6

Identifiers

CAS number
621-91-0
SMILES
c1ccc(COc2ccc(OCc3ccccc3)cc2)cc1
InChIKey
DYULYMCXVSRUPB-UHFFFAOYSA-N
InChI
InChI=1S/C20H18O2/c1-3-7-17(8-4-1)15-21-19-11-13-20(14-12-19)22-16-18-9-5-2-6-10-18/h1-14H,15-16H2

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Names and synonyms

10 names
  • Benzene, 1,4-bis(phenylmethoxy)-
  • Benzene, p-bis(benzyloxy)-
  • 1,4-Bis(phenylmethoxy)benzene
  • p-Di(benzyloxy)benzene
  • 1,4-Di(benzyloxy)benzene
  • p-Bis(benzyloxy)benzene
  • p-Hydroxyphenol dibenzyl ether
  • NSC 2206
  • 1,4-Bis(benzyloxy)benzene
  • TS 425

Work with Hydroquinone dibenzyl ether

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-Benzyloxyaniline6373-46-278 % similar Monobenzone103-16-275 % similar 1-Fluoro-4-(phenylmethoxy)benzene370-78-575 % similar 1-(Benzyloxy)-4-bromobenzene6793-92-675 % similar 4-Benzyloxybenzyl chloride836-42-072 % similar 4-(Benzyloxy)benzyl alcohol836-43-172 % similar 4-(Phenylmethoxy)aniline hydrochloride51388-20-669 % similar 4-(Phenylmethoxy)benzeneethanol61439-59-669 % similar

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

Same formula

(2S)-1,1,2-Triphenyl-1,2-ethanediol108998-83-0 1,1-Bis(4-hydroxyphenyl)-1-phenylethane1571-75-1

Elsewhere

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