CAS 13013-02-0

Methyl 4-nitrobutyrate

Description:

Methyl 4-nitrobutyrate is an organic compound characterized by its ester functional group, derived from butyric acid and 4-nitroaniline. It typically appears as a colorless to pale yellow liquid with a fruity odor. The presence of the nitro group (-NO2) on the butyrate chain contributes to its reactivity and potential applications in organic synthesis. This compound is soluble in organic solvents, such as ethanol and ether, but has limited solubility in water due to its hydrophobic nature. Methyl 4-nitrobutyrate is often used as an intermediate in the synthesis of pharmaceuticals and agrochemicals, as well as in the production of various chemical compounds. It is important to handle this substance with care, as it may pose health risks if inhaled or ingested, and appropriate safety measures should be taken during its use and storage. As with many nitro compounds, it may also be subject to regulations regarding its environmental impact and potential toxicity.

Formula: C₅H₉NO₄

InChI: InChI=1/C5H9NO4/c1-10-5(7)3-2-4-6(8)9/h2-4H2,1H3

InChI key: InChIKey=UBSPKGKFFQKZJB-UHFFFAOYSA-N

SMILES: C(CCCN(=O)=O)(OC)=O

Synonyms:

• 4-Nitrobutanoic acid methyl ester
• 4-Nitrobutyric acid methyl ester
• Brn 1766154
• Butanoic acid, 4-nitro-, methyl ester
• Butanoic acid, 4-nitro-, methyl ester (9CI)
• Butyric acid, 4-nitro-, methyl ester
• Methyl 4-Nitrobutanoate
• Nsc 126459
• Methyl 4-nitrobutyrate
• 4-02-00-00840 (Beilstein Handbook Reference)
• Methyl 4-nitrobutyrate
• 4-nitro-butyricacimethylester
• Methyl 4-nitrobutyrate,80%,tech.
• Methyl 4-nitrobutyrate, tech., 80% 5GR
• CBI-BB ZERO/005216
• METHYL 4-NITROBUTYRATE, TECH. 80%

Butanoic acid, 4-nitro-, methyl ester

CAS: 13013-02-0

Formula: C₅H₉NO₄

Purity: 97%

Color and Shape: Liquid

Molecular weight: 147.1293

Ref: IN-DA000U2A

Methyl 4-nitrobutanoate

CAS: 13013-02-0

Methyl 4-nitrobutanoate

Formula: C₅H₉NO₄

Purity: 98%

Color and Shape: pale-yellow liquid

Molecular weight: 147.13g/mol

Ref: 54-OR922231

4-Nitrobutyric Acid Methyl Ester

Controlled Product

CAS: 13013-02-0

Applications Butyric acid derivative. Displays some anti-inflammatory activity.

Formula: C₅H₉NO₄

Color and Shape: Neat

Molecular weight: 147.13

Ref: TR-N495810

4-Nitrobutyric Acid Methyl Ester

CAS: 13013-02-0

4-Nitrobutyric Acid Methyl Ester is a compound that belongs to the group of nitro compounds. It is an antimycobacterial agent that inhibits the growth of Mycobacterium tuberculosis by inhibiting the synthesis of mycolic acids and cell wall components. 4-Nitrobutyric Acid Methyl Ester has been shown to be effective in vitro against Mycobacterium avium complex and in animal models against Mycobacterium bovis. This molecule was synthesized by means of a solid-phase synthesis, with a stereoselective process yielding 98% ee.

Formula: C₅H₉NO₄

Purity: Min. 95%

Molecular weight: 147.13 g/mol

Ref: 3D-NAA01302