METHYL 3-CYANO-4-METHOXYBENZOATE

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CAS:25978-74-9
Purity:98% Package:1kg;|10kg;|100kg
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CAS:25978-74-9
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CAS:25978-74-9
Purity:99% Package:1kg
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CAS:25978-74-9
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Products Intro: Product Name:Methyl 3-cyano-4-methoxybenzoate
CAS:25978-74-9

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METHYL 3-CYANO-4-METHOXYBENZOATE Basic information
Uses
Product Name:METHYL 3-CYANO-4-METHOXYBENZOATE
Synonyms:METHYL 3-CYANO-4-METHOXYBENZOATE;3-Cyano-4-methoxybenzoic acid methyl ester;Benzoic acid, 3-cyano-4-methoxy-, methyl ester;methyl 3-cyano-4-methoxybenzoate - [M85982]
CAS:25978-74-9
MF:C10H9NO3
MW:191.18
EINECS:000-000-0
Product Categories:Aromatic Esters
Mol File:25978-74-9.mol
METHYL 3-CYANO-4-METHOXYBENZOATE Structure
METHYL 3-CYANO-4-METHOXYBENZOATE Chemical Properties
Melting point 124 °C
Boiling point 339.7±27.0 °C(Predicted)
density 1.20±0.1 g/cm3(Predicted)
storage temp. Sealed in dry,Room Temperature
AppearanceWhite to yellow Solid
BRN 2374769
InChIInChI=1S/C10H9NO3/c1-13-9-4-3-7(10(12)14-2)5-8(9)6-11/h3-5H,1-2H3
InChIKeyRYJSFYBJYKFNCF-UHFFFAOYSA-N
SMILESC(OC)(=O)C1=CC=C(OC)C(C#N)=C1
CAS DataBase Reference25978-74-9
Safety Information
Risk Statements 20/21/22-36/37/38
Safety Statements 26-36/37/39
RIDADR 3439
HazardClass 6.1
PackingGroup III
HS Code 2926907090
MSDS Information
ProviderLanguage
ALFA English
METHYL 3-CYANO-4-METHOXYBENZOATE Usage And Synthesis
UsesMethyl 3-Cyano-4-methoxybenzoate is a useful research chemical.
Synthesis
METHYL 3-BROMO-4-METHOXYBENZOATE  98

35450-37-4

METHYL 3-CYANO-4-METHOXYBENZOATE

25978-74-9

General procedure for the synthesis of methyl 3-cyano-4-methoxybenzoate from methyl 3-bromo-4-methoxybenzoate: to a solution of methyl 3-bromo-4-methoxybenzoate (1.1 g, 4.4 mmol) in dimethylformamide (10 mL) was added cuprous cyanide (1.2 g, 13.2 mmol). The reaction mixture was heated to 140 °C and maintained for 6 hours. After the reaction was completed, it was cooled to room temperature and diluted by adding ethyl acetate (25 mL). The organic phase was washed with saturated sodium chloride solution, dried over anhydrous sodium sulfate and concentrated under reduced pressure. The crude product was purified by fast column chromatography (eluent: petroleum ether/ethyl acetate=10:1) to afford methyl 3-cyano-4-methoxybenzoate (662 mg, 79% yield) as a white solid.

References[1] Patent: CN106146504, 2016, A. Location in patent: Paragraph 0219; 0220; 0221; 0224; 0225
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