Ethyl N-(2,4,5-trichlorophenyl)carbamate
TL;DR: Ethyl N-(2,4,5-trichlorophenyl)carbamate (CAS 50686-23-2) is a chemical compound with molecular formula C9H8Cl3NO2 and molecular weight 266.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(2,4,5-trichlorophenyl)carbamate
Also Known As: 2,4,5-Trichlor-phenylurethan, Ethyl N-(2,4,5-trichlorophenyl)carbamate, ethyl(2,4,5-trichlorophenyl)carbamate, Ethyl (2,4,5-trichlorophenyl)carbamate, ethyl 2,4,5-trichlorophenylcarbamate
| Molecular Formula | C9H8Cl3NO2 |
|---|---|
| Molecular Weight | 266.96 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.96207 |
| Heavy Atoms | 15 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 50686-23-2 |
|---|---|
| SMILES | CCOC(=O)NC1=CC(=C(C=C1Cl)Cl)Cl |
| InChIKey | WVPOWISSEQOJEZ-UHFFFAOYSA-N |
Product Overview
Ethyl N-(2,4,5-trichlorophenyl)carbamate (CAS 50686-23-2), with molecular formula C9H8Cl3NO2 and molecular weight 266.96 g/mol. IUPAC: ethyl N-(2,4,5-trichlorophenyl)carbamate.
Chemical Property Profile of Ethyl N-(2,4,5-trichlorophenyl)carbamate
Property Insights of Ethyl N-(2,4,5-trichlorophenyl)carbamate
The XLogP value of 3.8 indicates that Ethyl N-(2,4,5-trichlorophenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Ethyl N-(2,4,5-trichlorophenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl N-(2,4,5-trichlorophenyl)carbamate has 1 hydrogen bond donor(s) and 2 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 Ethyl N-(2,4,5-trichlorophenyl)carbamate?
The CAS number of Ethyl N-(2,4,5-trichlorophenyl)carbamate is 50686-23-2.
What is the molecular formula of Ethyl N-(2,4,5-trichlorophenyl)carbamate?
The molecular formula of Ethyl N-(2,4,5-trichlorophenyl)carbamate is C9H8Cl3NO2.
What is the molecular weight of Ethyl N-(2,4,5-trichlorophenyl)carbamate?
The molecular weight of Ethyl N-(2,4,5-trichlorophenyl)carbamate is 266.96 g/mol.
Where can I buy Ethyl N-(2,4,5-trichlorophenyl)carbamate?
You can request a quote for Ethyl N-(2,4,5-trichlorophenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl N-(2,4,5-trichlorophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl N-(2,4,5-trichlorophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.