Allyl 2'-chlorocarbanilate
TL;DR: Allyl 2'-chlorocarbanilate (CAS 25217-00-9) is a chemical compound with molecular formula C10H10ClNO2 and molecular weight 211.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl N-(2-chlorophenyl)carbamate
Also Known As: Allyl 2'-chlorocarbanilate, allyl 2-chlorophenylcarbamate, Allyl (2-chlorophenyl)carbamate, Prop-2-enyl N-(2-chlorophenyl)carbamate, prop-2-en-1-yl N-(2-chlorophenyl)carbamate
| Molecular Formula | C10H10ClNO2 |
|---|---|
| Molecular Weight | 211.04 g/mol |
| LogP | 3.0745 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.04001 |
| Heavy Atoms | 14 |
| Complexity | 338.6488 |
Chemical Identifiers
| CAS Number | 25217-00-9 |
|---|---|
| SMILES | C=CCOC(=O)NC1=CC=CC=C1Cl |
Product Overview
Allyl 2'-chlorocarbanilate (CAS 25217-00-9), with molecular formula C10H10ClNO2 and molecular weight 211.04 g/mol. IUPAC: prop-2-enyl N-(2-chlorophenyl)carbamate.
Chemical Property Profile of Allyl 2'-chlorocarbanilate
Property Insights of Allyl 2'-chlorocarbanilate
The XLogP value of 3.0745 indicates that Allyl 2'-chlorocarbanilate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, Allyl 2'-chlorocarbanilate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allyl 2'-chlorocarbanilate 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 Allyl 2'-chlorocarbanilate?
The CAS number of Allyl 2'-chlorocarbanilate is 25217-00-9.
What is the molecular formula of Allyl 2'-chlorocarbanilate?
The molecular formula of Allyl 2'-chlorocarbanilate is C10H10ClNO2.
What is the molecular weight of Allyl 2'-chlorocarbanilate?
The molecular weight of Allyl 2'-chlorocarbanilate is 211.04 g/mol.
Where can I buy Allyl 2'-chlorocarbanilate?
You can request a quote for Allyl 2'-chlorocarbanilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allyl 2'-chlorocarbanilate?
Yes, KEHONG BIO provides custom synthesis services for Allyl 2'-chlorocarbanilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.