Ethyl 2-chloropyridin-3-ylcarbamate
TL;DR: Ethyl 2-chloropyridin-3-ylcarbamate (CAS 545384-32-5) is a chemical compound with molecular formula C8H9ClN2O2 and molecular weight 200.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(2-chloro-3-pyridinyl)carbamate
Also Known As: Ethyl 2-chloropyridin-3-ylcarbamate, Ethyl N-(2-chloropyridin-3-yl)carbamate, ethyl (2-chloropyridin-3-yl)carbamate, N-(2-chloro-3-pyridinyl)carbamic acid ethyl ester
| Molecular Formula | C8H9ClN2O2 |
|---|---|
| Molecular Weight | 200.04 g/mol |
| LogP | 2.3034 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.03525 |
| Heavy Atoms | 13 |
| Complexity | 303.95044 |
Chemical Identifiers
| CAS Number | 545384-32-5 |
|---|---|
| SMILES | CCOC(=O)NC1=C(N=CC=C1)Cl |
Product Overview
Ethyl 2-chloropyridin-3-ylcarbamate (CAS 545384-32-5), with molecular formula C8H9ClN2O2 and molecular weight 200.04 g/mol. IUPAC: ethyl N-(2-chloro-3-pyridinyl)carbamate.
Chemical Property Profile of Ethyl 2-chloropyridin-3-ylcarbamate
Property Insights of Ethyl 2-chloropyridin-3-ylcarbamate
The XLogP value of 2.3034 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-chloropyridin-3-ylcarbamate. With a topological polar surface area (TPSA) of 51.22 Ų, Ethyl 2-chloropyridin-3-ylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-chloropyridin-3-ylcarbamate has 1 hydrogen bond donor(s) and 3 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 2-chloropyridin-3-ylcarbamate?
The CAS number of Ethyl 2-chloropyridin-3-ylcarbamate is 545384-32-5.
What is the molecular formula of Ethyl 2-chloropyridin-3-ylcarbamate?
The molecular formula of Ethyl 2-chloropyridin-3-ylcarbamate is C8H9ClN2O2.
What is the molecular weight of Ethyl 2-chloropyridin-3-ylcarbamate?
The molecular weight of Ethyl 2-chloropyridin-3-ylcarbamate is 200.04 g/mol.
Where can I buy Ethyl 2-chloropyridin-3-ylcarbamate?
You can request a quote for Ethyl 2-chloropyridin-3-ylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-chloropyridin-3-ylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-chloropyridin-3-ylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.