![2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate structure](/static/products/7103/71033-46-0.webp)
2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate
TL;DR: 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate (CAS 71033-46-0) is a chemical compound with molecular formula C12H13Cl2NO4 and molecular weight 305.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroethyl 2-[(3-chlorophenyl)carbamoyloxy]propanoate
Also Known As: 2-chloroethyl 2-[(3-chlorophenyl)carbamoyloxy]propanoate, 2-chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate, 2-Butanone,4-(2-phenanthrenylsulfonyl)-4-phenyl, Propanoic acid, 2-[[[(3-chlorophenyl)amino]carbonyl]oxy]-,2-chloroethyl ester
| Molecular Formula | C12H13Cl2NO4 |
|---|---|
| Molecular Weight | 305.02 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 305.02216 |
| Heavy Atoms | 19 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 71033-46-0 |
|---|---|
| SMILES | CC(C(=O)OCCCl)OC(=O)NC1=CC(=CC=C1)Cl |
| InChIKey | RLAPKRSEFMXZNN-UHFFFAOYSA-N |
Product Overview
2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate (CAS 71033-46-0), with molecular formula C12H13Cl2NO4 and molecular weight 305.02 g/mol. IUPAC: 2-chloroethyl 2-[(3-chlorophenyl)carbamoyloxy]propanoate.
Chemical Property Profile of 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate
Property Insights of 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate
The XLogP value of 3.0 indicates that 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate. Following Lipinski's Rule of Five, 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate?
The CAS number of 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate is 71033-46-0.
What is the molecular formula of 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate?
The molecular formula of 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate is C12H13Cl2NO4.
What is the molecular weight of 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate?
The molecular weight of 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate is 305.02 g/mol.
Where can I buy 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate?
You can request a quote for 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloroethyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.