Benzyl methyl ether

C8H10OCAS 538-86-3122.17 g/mol

Open in Covalent MOL file
O
Ether

Properties

Molecular formula
C8H10O
Molar mass
122.17 g/mol
Exact mass
122.0732 Da
Density
0.96 g/mL
Melting point
−52.6 °C
Boiling point
170 °C
logP
1.83Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

Warning
Flammable (GHS02)Irritant (GHS07)

Aggregated from 1,421 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P264+P265, P280, P303+P361+P353, P305+P351+P338, P337+P317, P370+P378, P403+P235, P501

Identifiers

CAS number
538-86-3
SMILES
COCc1ccccc1
InChIKey
GQKZBCPTCWJTAS-UHFFFAOYSA-N
InChI
InChI=1S/C8H10O/c1-9-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3

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Names and synonyms

7 names
  • Benzene, (methoxymethyl)-
  • Ether, benzyl methyl
  • (Methoxymethyl)benzene
  • Methyl benzyl ether
  • α-Methoxytoluene
  • NSC 8058
  • 1-(Methoxymethyl)benzene

Work with Benzyl methyl 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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,4-Bis(methoxymethyl)benzene6770-38-374 % similar 4,4′-Bis(methoxymethyl)-1,1′-biphenyl3753-18-264 % similar (2-Methoxyethyl)benzene3558-60-961 % similar 1,1′-Oxybis[4-(methoxymethyl)benzene]2509-26-458 % similar Dibenzyl ether103-50-457 % similar Benzyloxytrimethylsilane14642-79-650 % similar Hydroquinone dibenzyl ether621-91-050 % similar O-Benzylhydroxylamine622-33-350 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Methylanisole100-84-5 Ethyl phenyl ether103-73-1 4-Methylanisole104-93-8 2,4-Dimethylphenol105-67-9 3,5-Dimethylphenol108-68-9 4-Ethylphenol123-07-9 Dimethylphenol1300-71-6 1-Phenylethanol13323-81-4

Elsewhere

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