CAS 13450-77-6

N-(4-Chlorobenzoyl)glycine

Description:

N-(4-Chlorobenzoyl)glycine, with the CAS number 13450-77-6, is an organic compound that features a glycine moiety substituted with a 4-chlorobenzoyl group. This compound typically appears as a white to off-white crystalline solid. It is characterized by its functional groups, which include an amine (from glycine) and a carbonyl (from the benzoyl group), contributing to its potential reactivity and solubility in various solvents. The presence of the chlorine atom on the benzoyl ring can influence its electronic properties and biological activity. N-(4-Chlorobenzoyl)glycine may exhibit applications in pharmaceuticals, particularly in the development of drugs or as intermediates in organic synthesis. Its properties, such as melting point, solubility, and stability, can vary based on environmental conditions and the presence of other substances. As with many chemical compounds, safety data sheets should be consulted for handling and toxicity information, as well as for any specific regulatory considerations.

Formula: C₉H₈ClNO₃

InChI: InChI=1S/C9H8ClNO3/c10-7-3-1-6(2-4-7)9(14)11-5-8(12)13/h1-4H,5H2,(H,11,14)(H,12,13)

InChI key: InChIKey=COYZIYOEXGRBHQ-UHFFFAOYSA-N

SMILES: C(NCC(O)=O)(=O)C1=CC=C(Cl)C=C1

Synonyms:

• 2-(4-Chlorobenzamido)acetic acid
• 2-(4-Chlorobenzamido)aceticacid
• 2-[(4-Chlorophenyl)formamido]acetic acid
• 4-Chlorobenzoylglycine
• 4-Chlorohippuric acid
• 4-Chlorohippuricacid
• Glycine, N-(4-chlorobenzoyl)-
• Hippuric acid, p-chloro-
• N-(4-Chlorobenzoyl)-Glycin
• N-(4-Chlorobenzoyl)Glycine
• N-(P-Chlorobenzoyl)Glycine
• Otava-Bb Bb7210742318
• P-Chloro-Hippuricaci
• P-Chlorobenzoylglycine
• Ro 11-1903
• p-Chlorohippuric acid

2-(4-Chlorobenzamido)acetic acid

CAS: 13450-77-6

Formula: C₉H₈ClNO₃

Purity: 95%

Color and Shape: Solid

Molecular weight: 213.6177

Ref: IN-DA007ZYC

2-(4-Chlorobenzamido)acetic acid

CAS: 13450-77-6

2-(4-Chlorobenzamido)acetic acid

Purity: 97%

Molecular weight: 213.62g/mol

Ref: 54-OR90840

4-Chloro Hippuric Acid

CAS: 13450-77-6

Formula: C₉H₈ClNO₃

Molecular weight: 213.62

Ref: ST-EA-CP-M65002

4-Chlorohippuric Acid

Controlled Product

CAS: 13450-77-6

Applications 4-Chlorohippuric Acid is a derivative of Hippuric Acid (H356700) and is the major metabolite in human urine.
References Köppel, C., et al.: Arzneimittel-Forsch., 36, 1116 (1986); Oelschläger, H., et al.: Die Pharmazie, 53, 620 (1998)

Formula: C₉H₈ClNO₃

Color and Shape: White To Off-White

Molecular weight: 213.62

Ref: TR-C367420

(4-Chloro-benzoylamino)-acetic acid

CAS: 13450-77-6

Formula: C₉H₈ClNO₃

Purity: 98%

Color and Shape: Solid

Molecular weight: 213.62

Ref: 10-F060365

4-Chlorohippuric Acid-d4

Controlled Product

CAS: 13450-77-6

Applications 4-Chlorohippuric Acid-d4 is the isotope labelled analog of 4-Chlorohippuric Acid (C367420); a derivative of Hippuric Acid (H356700) and the major metabolite in human urine.
References Köppel, C., et al.: Arzneimittel-Forsch., 36, 1116 (1986); Oelschläger, H., et al.: Die Pharmazie, 53, 620 (1998)

Formula: C₉H₄D₄ClNO₃

Color and Shape: Neat

Molecular weight: 217.64

Ref: TR-C367422

4-Chlorohippuric acid

CAS: 13450-77-6

4-Chlorohippuric acid is an active analogue of hippuric acid and is metabolized by cytochrome P450. It has a high chemical stability, which makes it a useful substrate for kinetic studies. The metabolism of 4-chlorohippuric acid to the corresponding sulfoxide (4-chloro-3'-sulfoxyhippurate) was found to be dependent on the concentration of rat liver microsomes in vitro and plasma concentrations in vivo. 4-Chlorohippuric acid is excreted mainly as hippuric acid in urine samples from humans and animals. Hippuric acid may also be formed by denaturation of 4-chlorohippurate or by hydrolysis of the amide bond between the two chloro groups.

Formula: C₉H₈ClNO₃

Purity: Min. 95%

Molecular weight: 213.62 g/mol

Ref: 3D-NAA45077