Ethyl N-(3,4-dichlorophenyl)carbamate
TL;DR: Ethyl N-(3,4-dichlorophenyl)carbamate (CAS 7159-94-6) is a chemical compound with molecular formula C9H9Cl2NO2 and molecular weight 233.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(3,4-dichlorophenyl)carbamate
Also Known As: ethyl (3,4-dichlorophenyl)carbamate, Ethyl N-(3,4-dichlorophenyl)carbamate, TimTec1_000992, N-(3,4-Dichlorophenyl)carbamic acid, 3,4-dichlorphenyl ethylcarbamate
| Molecular Formula | C9H9Cl2NO2 |
|---|---|
| Molecular Weight | 233.00 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.00104 |
| Heavy Atoms | 14 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 7159-94-6 |
|---|---|
| SMILES | CCOC(=O)NC1=CC(=C(C=C1)Cl)Cl |
| InChIKey | AOVLXBXJFYNQAZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl N-(3,4-dichlorophenyl)carbamate (CAS 7159-94-6), with molecular formula C9H9Cl2NO2 and molecular weight 233.00 g/mol. IUPAC: ethyl N-(3,4-dichlorophenyl)carbamate.
Chemical Property Profile of Ethyl N-(3,4-dichlorophenyl)carbamate
Property Insights of Ethyl N-(3,4-dichlorophenyl)carbamate
The XLogP value of 3.9 indicates that Ethyl N-(3,4-dichlorophenyl)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-(3,4-dichlorophenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl N-(3,4-dichlorophenyl)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-(3,4-dichlorophenyl)carbamate?
The CAS number of Ethyl N-(3,4-dichlorophenyl)carbamate is 7159-94-6.
What is the molecular formula of Ethyl N-(3,4-dichlorophenyl)carbamate?
The molecular formula of Ethyl N-(3,4-dichlorophenyl)carbamate is C9H9Cl2NO2.
What is the molecular weight of Ethyl N-(3,4-dichlorophenyl)carbamate?
The molecular weight of Ethyl N-(3,4-dichlorophenyl)carbamate is 233.00 g/mol.
Where can I buy Ethyl N-(3,4-dichlorophenyl)carbamate?
You can request a quote for Ethyl N-(3,4-dichlorophenyl)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-(3,4-dichlorophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl N-(3,4-dichlorophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.