2,6-Dimethoxybenzonitrile

C₉H₉NO₂CAS 16932-49-3163.18 g/mol

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Properties

Molecular formula: C₉H₉NO₂
Molar mass: 163.18 g/mol
Exact mass: 163.0633 Da
Melting point: 119 °C
Boiling point: 310 °C
logP: 1.58Crippen estimate
Polar surface area: 42.3 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

Identifiers

CAS number

16932-49-3

SMILES

COc1cccc(OC)c1C#N

InChIKey

XHAHKSSLDJIEDH-UHFFFAOYSA-N

InChI

InChI=1S/C9H9NO2/c1-11-8-4-3-5-9(12-2)7(8)6-10/h3-5H,1-2H3

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

Names and synonyms

3 names

Benzonitrile, 2,6-dimethoxy-
2-Cyano-3-methoxyanisole
NSC 27017

Work with 2,6-Dimethoxybenzonitrile

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

Same formula

2,6-Diacetylpyridine1129-30-2 1-Phenyl-1,2-propanedione 2-oxime119-51-7 4-Acetamidobenzaldehyde122-85-0 (±)-Indoline-2-carboxylic acid16851-56-2 2,5-Dimethyl-β-oxo-3-furanpropanenitrile175276-62-7 3,5-Dimethoxybenzonitrile19179-31-8 3,4-Dimethoxybenzonitrile2024-83-1 7-Hydroxy-3,4-dihydro-2(1H)-quinolinone22246-18-0

Elsewhere

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