CAS 136204-68-7

Carbamic acid, (4-chlorophenyl)-, 2-[[(1-methylethoxy)carbonyl]amino]ethyl ester

Description:

Carbamic acid, (4-chlorophenyl)-, 2-[[(1-methylethoxy)carbonyl]amino]ethyl ester, with CAS number 136204-68-7, is a chemical compound characterized by its carbamate functional group, which is derived from carbamic acid. This compound features a 4-chlorophenyl group, indicating the presence of a chlorine atom on a phenyl ring, which can influence its reactivity and biological activity. The structure includes an ethyl ester moiety, suggesting it may exhibit properties typical of esters, such as volatility and solubility in organic solvents. The presence of the methylethoxy carbonyl group indicates potential for hydrogen bonding and steric effects, which can affect its interaction with biological targets. This compound may be of interest in medicinal chemistry due to its potential pharmacological properties, particularly in the development of agrochemicals or pharmaceuticals. Its specific characteristics, such as melting point, boiling point, and solubility, would depend on the molecular interactions and the overall structure, which can be further explored through experimental data.

Formula: C₁₃H₁₇ClN₂O₄

InChI: InChI=1S/C13H17ClN2O4/c1-9(2)20-12(17)15-7-8-19-13(18)16-11-5-3-10(14)4-6-11/h3-6,9H,7-8H2,1-2H3,(H,15,17)(H,16,18)

InChI key: InChIKey=OYGKZISHHKFFGI-UHFFFAOYSA-N

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

Synonyms:

• 2-[(Isopropoxycarbonyl)amino]ethyl (4-chlorophenyl)carbamate
• 2-{[(1-Methylethoxy)Carbonyl]Amino}Ethyl (4-Chlorophenyl)Carbamate (Non-Preferred Name)
• Kartolin 2
• Carbamic acid, (4-chlorophenyl)-, 2-[[(1-methylethoxy)carbonyl]amino]ethyl ester

N-(Isopropoxycarbonyl)-O-(4-chlorophenylcarbamoyl)ethanolamine

Controlled Product

CAS: 136204-68-7

Applications N-(Isopropoxycarbonyl)-O-(4-chlorophenylcarbamoyl)ethanolamine is a phosgenic agent and plant growth regulator.
References Sheshenev, A., et al.: Russ. 7 (2020)

Formula: C₁₃H₁₇ClN₂O₄

Color and Shape: Neat

Molecular weight: 300.7381

Ref: TR-I489520