Carbamic acid, allyldithio-, p-chlorophenyl ester
TL;DR: Carbamic acid, allyldithio-, p-chlorophenyl ester (CAS 72024-55-6) is a chemical compound with molecular formula C10H10ClNS2 and molecular weight 242.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl) N-prop-2-enylcarbamodithioate
Also Known As: p-Chlorophenyl allyldithiocarbamate, Allyldithiocarbamic acid p-chlorophenyl ester, (4-chlorophenyl) N-prop-2-enylcarbamodithioate, CARBAMIC ACID, ALLYLDITHIO-, p-CHLOROPHENYL ESTER, 4-Chlorophenyl prop-2-en-1-ylcarbamodithioate
| Molecular Formula | C10H10ClNS2 |
|---|---|
| Molecular Weight | 242.99 g/mol |
| LogP | 3.4926 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.99432 |
| Heavy Atoms | 14 |
| Complexity | 321.3988 |
Chemical Identifiers
| CAS Number | 72024-55-6 |
|---|---|
| SMILES | C=CCNC(=S)SC1=CC=C(C=C1)Cl |
Product Overview
Carbamic acid, allyldithio-, p-chlorophenyl ester (CAS 72024-55-6), with molecular formula C10H10ClNS2 and molecular weight 242.99 g/mol. IUPAC: (4-chlorophenyl) N-prop-2-enylcarbamodithioate.
Chemical Property Profile of Carbamic acid, allyldithio-, p-chlorophenyl ester
Property Insights of Carbamic acid, allyldithio-, p-chlorophenyl ester
The XLogP value of 3.4926 indicates that Carbamic acid, allyldithio-, p-chlorophenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, Carbamic acid, allyldithio-, p-chlorophenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, allyldithio-, p-chlorophenyl 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, allyldithio-, p-chlorophenyl ester?
The CAS number of Carbamic acid, allyldithio-, p-chlorophenyl ester is 72024-55-6.
What is the molecular formula of Carbamic acid, allyldithio-, p-chlorophenyl ester?
The molecular formula of Carbamic acid, allyldithio-, p-chlorophenyl ester is C10H10ClNS2.
What is the molecular weight of Carbamic acid, allyldithio-, p-chlorophenyl ester?
The molecular weight of Carbamic acid, allyldithio-, p-chlorophenyl ester is 242.99 g/mol.
Where can I buy Carbamic acid, allyldithio-, p-chlorophenyl ester?
You can request a quote for Carbamic acid, allyldithio-, p-chlorophenyl 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, allyldithio-, p-chlorophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, allyldithio-, p-chlorophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.