chempirical

3,5-Dibenzyloxybenzyl alcohol

C21H20O3CAS 24131-31-5320.39 g/mol

Open in Covalent MOL file
OHOO
AlcoholEther

Properties

Molecular formula
C21H20O3
Molar mass
320.39 g/mol
Exact mass
320.1412 Da
logP
4.34Crippen estimate
Polar surface area
38.7 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
7

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
24131-31-5
SMILES
C1=CC=C(C=C1)COC2=CC(=CC(=C2)CO)OCC3=CC=CC=C3
InChIKey
MHHXKZKHZMSINU-UHFFFAOYSA-N
InChI
InChI=1S/C21H20O3/c22-14-19-11-20(23-15-17-7-3-1-4-8-17)13-21(12-19)24-16-18-9-5-2-6-10-18/h1-13,22H,14-16H2

Weigh it out

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Work with 3,5-Dibenzyloxybenzyl alcohol

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

3-(Phenylmethoxy)benzenemethanol1700-30-777 % similar 4-(Benzyloxy)benzyl alcohol836-43-170 % similar 3,5-Bis(benzyloxy)benzyl bromide24131-32-663 % similar 1,3-Dibenzyloxybenzene3769-42-462 % similar Hydroquinone dibenzyl ether621-91-057 % similar 3-Phenoxybenzyl alcohol13826-35-255 % similar 3,5-Dibenzyloxybenzaldehyde14615-72-654 % similar 3,5-Bis(phenylmethoxy)benzoic acid28917-43-354 % similar

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

Elsewhere

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