ChemicalBook--->CAS DataBase List--->406719-76-4

406719-76-4

406719-76-4 Structure

406719-76-4 Structure
IdentificationBack Directory
[Name]

Methyl 4-cyano-2-methoxybenzoate
[CAS]

406719-76-4
[Synonyms]

Methyl 4-cyano-2-methoxybenzoate
Methyl 4-cyano-2-methoxybenzoate 95+%
[Molecular Formula]

C10H9NO3
[MDL Number]

MFCD18399095
[MOL File]

406719-76-4.mol
[Molecular Weight]

191.18
Chemical PropertiesBack Directory
[Boiling point ]

323.7±32.0 °C(Predicted)
[density ]

1.20±0.1 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[Appearance]

White to yellow Solid
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Flame (GHS02)
GHS07,GHS02
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332-H315-H319-H226
[Precautionary statements ]

P501-P261-P270-P240-P210-P233-P243-P241-P242-P271-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P301+P312+P330-P304+P340+P312-P403+P235
[HS Code ]

2916399090
Spectrum DetailBack Directory
[Spectrum Detail]

Methyl 4-cyano-2-methoxybenzoate(406719-76-4)1HNMR
Hazard InformationBack Directory
[Synthesis]

Methanol

67-56-1

4-Cyano-2-Methoxybenzoic acid

89469-52-3

Methyl 4-cyano-2-methoxybenzoate

406719-76-4

The general procedure for the synthesis of methyl 4-cyano-2-methoxybenzoate from methanol and 4-cyano-2-methoxybenzoic acid was as follows: 4-cyano-2-methoxybenzoic acid (1.00 g, 5.648 mmol, Biogene) was dissolved in methanol (15.0 mL), and p-toluenesulfonic acid monohydrate (286 mg, 1.48 mmol, and Aldrich) as a catalyst. The reaction mixture was heated to reflux under argon protection for 16 hours. After completion of the reaction, the solvent was removed by rotary evaporation. The reaction mixture was extracted with ethyl acetate (EtOAc) and washed sequentially with saturated sodium carbonate solution (Na2CO3), water and saturated sodium chloride solution (NaCl). The organic phase was separated, dried with anhydrous sodium sulfate (Na2SO4), filtered and concentrated to give methyl 4-cyano-2-methoxybenzoate (1.04 g, 96.4% yield).

[References]

[1] Patent: US2011/86854, 2011, A1. Location in patent: Page/Page column 42
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