Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester
TL;DR: Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester (CAS 32496-40-5) is a chemical compound with molecular formula C11H10ClNO2 and molecular weight 223.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-ynyl N-(5-chloro-2-methylphenyl)carbamate
Also Known As: Carbanilic acid,2-propynyl ester, Carbanilic acid, 2-propynyl ester, CARBAMIC ACID, N-(5-CHLORO-o-TOLYL)-, 2-PROPYNYL ESTER, prop-2-ynyl N-(5-chloro-2-methylphenyl)carbamate, CARBAMIC ACID, 2-PROPYNYL ESTER
| Molecular Formula | C11H10ClNO2 |
|---|---|
| Molecular Weight | 223.04 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.04001 |
| Heavy Atoms | 15 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 32496-40-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)NC(=O)OCC#C |
| InChIKey | VFRTXLLPFLJJGO-UHFFFAOYSA-N |
Product Overview
Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester (CAS 32496-40-5), with molecular formula C11H10ClNO2 and molecular weight 223.04 g/mol. IUPAC: prop-2-ynyl N-(5-chloro-2-methylphenyl)carbamate.
Chemical Property Profile of Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester
Property Insights of Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester. With a topological polar surface area (TPSA) of 38.3 Ų, Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester 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 Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester?
The CAS number of Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester is 32496-40-5.
What is the molecular formula of Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester?
The molecular formula of Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester is C11H10ClNO2.
What is the molecular weight of Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester?
The molecular weight of Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester is 223.04 g/mol.
Where can I buy Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester?
You can request a quote for Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, N-(5-chloro-o-tolyl)-, 2-propynyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.