CAS 619-50-1

Methyl 4-nitrobenzoate

Description:

Methyl 4-nitrobenzoate, with the CAS number 619-50-1, is an organic compound that belongs to the class of esters. It is characterized by its aromatic structure, featuring a nitro group (-NO2) and a methyl ester functional group. The compound typically appears as a pale yellow liquid or solid, depending on the temperature, and has a sweet, floral odor. Methyl 4-nitrobenzoate is known for its moderate solubility in organic solvents such as ethanol and ether, while being less soluble in water due to its hydrophobic aromatic ring. It is commonly used in organic synthesis and as an intermediate in the production of various pharmaceuticals and agrochemicals. The presence of the nitro group contributes to its reactivity, making it a useful compound in electrophilic aromatic substitution reactions. Additionally, it is important to handle this compound with care, as nitro compounds can be hazardous and may pose environmental risks.

Formula: C₈H₇NO₄

InChI: InChI=1S/C8H7NO4/c1-13-8(10)6-2-4-7(5-3-6)9(11)12/h2-5H,1H3

InChI key: InChIKey=YOJAHJGBFDPSDI-UHFFFAOYSA-N

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

Synonyms:

• 2-Methyl-4-Nitrobenzoate
• 4-Methoxycarbonylnitrobenzene
• 4-Nitrobenzoic acid methyl ester
• Benzoic acid, 4-nitro-, methyl ester
• Benzoic acid, p-nitro-, methyl ester
• Methyl 4-nitrobenzoate/4-Nitrobenzoic acid methyl ester
• Methyl DL-p-Hydroxyphenylglycine
• Methyl-p-nitrobenzoate
• NSC 4137
• p-Carbomethoxynitrobenzene
• p-Nitrobenzoic acid methyl ester

Methyl 4-Nitrobenzoate

CAS: 619-50-1

Formula: C₈H₇NO₄

Purity: >98.0%(GC)

Color and Shape: White to Yellow powder to crystal

Molecular weight: 181.15

Ref: 3B-N0159

Methyl 4-nitrobenzoate, 99%

CAS: 619-50-1

It is employed in the biochemical characterization of NfsA, the Escherichia coli major nitroreductase exhibiting a high amino acid sequence homology to Frp, a Vibrio harveyi flavin oxidoreductase. This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio.

Formula: C₈H₇NO₄

Purity: 99%

Color and Shape: White to yellow, Crystals or crystalline powder

Molecular weight: 181.15

Ref: 02-A12928

Benzoic acid, 4-​nitro-​, methyl ester

CAS: 619-50-1

Formula: C₈H₇NO₄

Purity: 98%

Color and Shape: Solid

Molecular weight: 181.1455

Ref: IN-DA003RW3

Methyl 4-nitrobenzoate

CAS: 619-50-1

Methyl 4-nitrobenzoate

Purity: 98%

Molecular weight: 181.15g/mol

Ref: 54-OR922109

Methyl 4-nitrobenzoate

CAS: 619-50-1

Methyl 4-nitrobenzoate is a diazonium salt that is used in the synthesis of other compounds. It is a colorless, crystalline solid that has a weakly acidic character with a pH of 2.5. The reaction between methyl 4-nitrobenzoate and hydrochloric acid produces nitrous acid, water, and methyl benzoate. This compound has significant antifungal activity against Candida albicans and Saccharomyces cerevisiae in vitro. Methyl 4-nitrobenzoate's chemical structures are nitro, methyl group, benzene ring, and oxygen atom. The kinetic data for this compound have been measured by using the kinetic technique. The activation energies for this compound are -2.8 kcal/mol for hydrolysis to benzoic acid and -3.0 kcal/mol for nitration to nitro-. Methyl 4-nitrobenzoate interacts with biological substances through a

Formula: C₈H₇NO₄

Purity: Min. 98%

Color and Shape: Powder

Molecular weight: 181.15 g/mol

Ref: 3D-FM71098

Methyl 4-nitrobenzoate

CAS: 619-50-1

Formula: C₈H₇NO₄

Purity: 95%

Color and Shape: Solid

Molecular weight: 181.147

Ref: 10-F463392

Methyl 4-Nitrobenzoate

Controlled Product

CAS: 619-50-1

Applications Methyl 4-nitrobenzoate (cas# 619-50-1) is a useful research chemical.

Formula: C₈H₇NO₄

Color and Shape: Neat

Molecular weight: 181.15

Ref: TR-M339643

Methyl 4-nitrobenzoate

CAS: 619-50-1

Formula: C₈H₇NO

Molecular weight: 181.15

Ref: ST-EA-CP-L27071