间氯苯胺基甲酸烯丙酯
TL;DR: 间氯苯胺基甲酸烯丙酯 (CAS 25070-79-5) 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.
间氯苯胺基甲酸烯丙酯
prop-2-enyl N-(3-chlorophenyl)carbamate
Also Known As: m-Chlorophenylcarbamic acid allyl ester, Carbamic acid, allyl ester, Allyl (3-chlorophenyl)carbamate, allyl 3-chlorophenylcarbamate, Carbanilic acid, allyl ester
| Molecular Formula | C10H10ClNO2 |
|---|---|
| Molecular Weight | 211.04 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 211.04001 |
| Heavy Atoms | 14 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 25070-79-5 |
|---|---|
| SMILES | C=CCOC(=O)NC1=CC(=CC=C1)Cl |
| InChIKey | AKUHKJFFZQUCEH-UHFFFAOYSA-N |
Product Overview
间氯苯胺基甲酸烯丙酯 (CAS 25070-79-5), with molecular formula C10H10ClNO2 and molecular weight 211.04 g/mol. IUPAC: prop-2-enyl N-(3-chlorophenyl)carbamate.
Chemical Property Profile of 间氯苯胺基甲酸烯丙酯
Property Insights of 间氯苯胺基甲酸烯丙酯
The XLogP value of 3.2 indicates that 间氯苯胺基甲酸烯丙酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 间氯苯胺基甲酸烯丙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 间氯苯胺基甲酸烯丙酯 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 间氯苯胺基甲酸烯丙酯?
The CAS number of 间氯苯胺基甲酸烯丙酯 is 25070-79-5.
What is the molecular formula of 间氯苯胺基甲酸烯丙酯?
The molecular formula of 间氯苯胺基甲酸烯丙酯 is C10H10ClNO2.
What is the molecular weight of 间氯苯胺基甲酸烯丙酯?
The molecular weight of 间氯苯胺基甲酸烯丙酯 is 211.04 g/mol.
Where can I buy 间氯苯胺基甲酸烯丙酯?
You can request a quote for 间氯苯胺基甲酸烯丙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 间氯苯胺基甲酸烯丙酯?
Yes, KEHONG BIO provides custom synthesis services for 间氯苯胺基甲酸烯丙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.