CAS 1129-35-7

Methyl 4-cyanobenzoate

Description:

Methyl 4-cyanobenzoate, with the CAS number 1129-35-7, is an organic compound that belongs to the class of benzoates. It features a methyl ester functional group and a cyano group attached to a benzene ring, specifically at the para position relative to the ester. This compound is typically a colorless to pale yellow liquid or solid, depending on the temperature and purity. It is known for its aromatic properties and is often used as an intermediate in organic synthesis, particularly in the production of pharmaceuticals and agrochemicals. Methyl 4-cyanobenzoate is soluble in organic solvents such as ethanol and acetone but has limited solubility in water. It exhibits moderate toxicity and should be handled with care, following appropriate safety protocols. The compound can undergo various chemical reactions, including nucleophilic substitutions and hydrolysis, making it a versatile building block in synthetic chemistry. Its unique structure contributes to its reactivity and potential applications in various chemical processes.

Formula: C₉H₇NO₂

InChI: InChI=1S/C9H7NO2/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-5H,1H3

InChI key: InChIKey=KKZMIDYKRKGJHG-UHFFFAOYSA-N

SMILES: C(OC)(=O)C1=CC=C(C#N)C=C1

Synonyms:

• 4-(Methoxycarbonyl)benzonitrile
• 4-Cy!nobenzoic acid methyl ester
• 4-Cyanobenzoic acid methyl ester
• Benzoic acid, 4-cyano-, methyl ester
• Benzoic acid, p-cyano-, methyl ester
• Cyanbenzoicacidmethylester
• Methyl p-cyanobenzoate
• p-Cyanobenzoic acid methyl ester
• Methyl 4-cyanobenzoate

Methyl 4-Cyanobenzoate

CAS: 1129-35-7

Formula: C₉H₇NO₂

Purity: >98.0%(GC)

Color and Shape: White to Light yellow powder to crystal

Molecular weight: 161.16

Ref: 3B-C1119

Methyl 4-cyanobenzoate, 99%

CAS: 1129-35-7

It finds its application in the chemoselective biotransformation of nitriles by Rhodococcus equi A4 and in the design of 3-(4-carboxybenzoyl)-2-quinolinecarboxaldehyde as a reagent for ultrasensitive determination of primary amines by capillary electrophoresis using laser fluorescence detection. Thi

Formula: C₉H₇NO₂

Purity: 99%

Color and Shape: Crystals or powder or crystalline powder or fused solid, White to cream to pale yellow

Molecular weight: 161.16

Ref: 02-L08365

Methyl 4-cyanobenzoate

CAS: 1129-35-7

Formula: C₉H₇NO₂

Purity: 96%

Color and Shape: Solid

Molecular weight: 161.1574

Ref: IN-DA003L96

Methyl 4-cyanobenzoate

CAS: 1129-35-7

Methyl 4-cyanobenzoate

Formula: C₉H₇NO₂

Purity: 98%

Color and Shape: off-white solid

Molecular weight: 161.16g/mol

Ref: 54-OR5721

Methyl-4-cyanobenzoate

CAS: 1129-35-7

Methyl-4-cyanobenzoate is a nucleophilic compound that reacts with electrophilic functional groups. It is used in organic chemistry as an immobilized reagent for the conversion of alcohols, amines, and thiols to their corresponding halides. Methyl-4-cyanobenzoate has been shown to have anti-inflammatory properties by inhibiting neutrophil migration into cutaneous tissue and reducing the production of proinflammatory compounds such as isobutene and naphthalene. It also inhibits the release of histamine from mast cells.

Formula: C₉H₇NO₂

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 161.16 g/mol

Ref: 3D-FM11948

Methyl 4-Cyanobenzoate

CAS: 1129-35-7

Formula: C₉H₇NO₂

Purity: 96%

Color and Shape: Solid, Powder

Molecular weight: 161.16

Ref: 10-F066752

Methyl 4-Cyanobenzoate-13C2,15N

Controlled Product

CAS: 1129-35-7

Formula: C₇C₂H₇NO₂

Color and Shape: Neat

Molecular weight: 164.14

Ref: TR-C714494

Methyl 4-Cyanobenzoate

Controlled Product

CAS: 1129-35-7

Applications Methyl 4-Cyanobenzoate (cas# 1129-35-7) is a compound useful in organic synthesis.

Formula: C₉H₇NO₂

Color and Shape: Neat

Molecular weight: 161.16

Ref: TR-M294770