chempirical

2-Methoxybenzonitrile

C8H7NOCAS 6609-56-9133.15 g/mol

Open in Covalent MOL file
ON
EtherNitrile

Properties

Molecular formula
C8H7NO
Molar mass
133.15 g/mol
Exact mass
133.0528 Da
Density
1.107 g/mL (at 20 °C)
Melting point
24.5 °C
Boiling point
255.5 °C
logP
1.57Crippen estimate
Polar surface area
33.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
6609-56-9
SMILES
COc1ccccc1C#N
InChIKey
FSTPMFASNVISBU-UHFFFAOYSA-N
InChI
InChI=1S/C8H7NO/c1-10-8-5-3-2-4-7(8)6-9/h2-5H,1H3

Weigh it out

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

Names and synonyms

6 names
  • Benzonitrile, 2-methoxy-
  • o-Anisonitrile
  • o-Methoxybenzonitrile
  • o-Cyanoanisole
  • 2-Cyanoanisole
  • 2-(Methyloxy)benzonitrile

Work with 2-Methoxybenzonitrile

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

2,3-Dimethoxybenzonitrile5653-62-371 % similar 1-Ethynyl-2-methoxybenzene767-91-961 % similar 2,5-Dimethoxybenzonitrile5312-97-060 % similar 4-Methoxy-1-naphthalenecarbonitrile5961-55-760 % similar 2,3,4-Trimethoxybenzonitrile43020-38-857 % similar 2-Ethoxybenzonitrile6609-57-057 % similar 1,2-Dimethoxybenzene91-16-757 % similar 5-Bromo-2-methoxybenzonitrile144649-99-056 % similar

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

Same formula

(+)-Mandelonitrile10020-96-9 5-Methylbenzoxazole10531-78-9 4-Hydroxybenzyl cyanide14191-95-8 3-Methoxybenzonitrile1527-89-5 5-Hydroxyindole1953-54-4 6-Hydroxyindole2380-86-1 1H-Indol-4-ol2380-94-1 Benzyl isocyanate3173-56-6

Elsewhere

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