Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester
TL;DR: Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester (CAS 122186-95-2) is a chemical compound with molecular formula C24H36ClNO4 and molecular weight 437.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
nonyl 3-[2-(4-acetamidobutanoyl)-5-chlorophenyl]propanoate
Also Known As: Nonyl 2-(4-acetamidobutyryl)-5-chlorohydrocinnamate, Nonyl 2-(4-(acetylamino)-1-oxobutyl)-5-chlorobenzenepropanoate, nonyl 3-[2-(4-acetamidobutanoyl)-5-chlorophenyl]propanoate, Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester, Benzenepropanoic acid,2-[4-(acetylamino)-1-oxobutyl]-5-chloro-, nonyl ester
| Molecular Formula | C24H36ClNO4 |
|---|---|
| Molecular Weight | 437.23 g/mol |
| LogP | 5.6654 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 437.23328 |
| Heavy Atoms | 30 |
| Complexity | 675.1698 |
Chemical Identifiers
| CAS Number | 122186-95-2 |
|---|---|
| SMILES | CCCCCCCCCOC(=O)CCC1=C(C=CC(=C1)Cl)C(=O)CCCNC(=O)C |
Product Overview
Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester (CAS 122186-95-2), with molecular formula C24H36ClNO4 and molecular weight 437.23 g/mol. IUPAC: nonyl 3-[2-(4-acetamidobutanoyl)-5-chlorophenyl]propanoate.
Chemical Property Profile of Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester
Property Insights of Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester
The XLogP value of 5.6654 indicates that Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester. Following Lipinski's Rule of Five, Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester?
The CAS number of Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester is 122186-95-2.
What is the molecular formula of Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester?
The molecular formula of Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester is C24H36ClNO4.
What is the molecular weight of Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester?
The molecular weight of Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester is 437.23 g/mol.
Where can I buy Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester?
You can request a quote for Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzenepropanoic acid, 2-(4-(acetylamino)-1-oxobutyl)-5-chloro-, nonyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.