Carbanilic acid, m-chlorodithio-, ethyl ester
TL;DR: Carbanilic acid, m-chlorodithio-, ethyl ester (CAS 13037-29-1) is a chemical compound with molecular formula C9H10ClNS2 and molecular weight 230.99432 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl N-(3-chlorophenyl)carbamodithioate
Also Known As: Ethyl m-chlorodithiocarbanilate, ethyl N-(3-chlorophenyl)carbamodithioate, m-Chlorodithiocarbanilic acid ethyl ester, m-Chlorophenyldithiocarbamic acid ethyl ester, S-Aethyl-N-(3-chlor-phenyl)-dithiocarbamat
Technical Specifications
| Molecular Formula | C9H10ClNS2 |
| Molecular Weight | 230.99432 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 69.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.99432 Da |
| Heavy Atoms | 13 |
| Complexity | 175.0 |
| SMILES | CCSC(=S)NC1=CC(=CC=C1)Cl |
| InChIKey | VKJZJFMDTGSGGW-UHFFFAOYSA-N |
Chemical Property Profile of Carbanilic acid, m-chlorodithio-, ethyl ester
Property Insights of Carbanilic acid, m-chlorodithio-, ethyl ester
The XLogP value of 3.6 indicates that Carbanilic acid, m-chlorodithio-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbanilic acid, m-chlorodithio-, ethyl ester. Following Lipinski's Rule of Five, Carbanilic acid, m-chlorodithio-, ethyl 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
What is the CAS number of Carbanilic acid, m-chlorodithio-, ethyl ester?
The CAS number of Carbanilic acid, m-chlorodithio-, ethyl ester is 13037-29-1.
What is the molecular formula of Carbanilic acid, m-chlorodithio-, ethyl ester?
The molecular formula of Carbanilic acid, m-chlorodithio-, ethyl ester is C9H10ClNS2.
What is the molecular weight of Carbanilic acid, m-chlorodithio-, ethyl ester?
The molecular weight of Carbanilic acid, m-chlorodithio-, ethyl ester is 230.99432 g/mol.
Where can I buy Carbanilic acid, m-chlorodithio-, ethyl ester?
You can request a quote for Carbanilic acid, m-chlorodithio-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbanilic acid, m-chlorodithio-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for Carbanilic acid, m-chlorodithio-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.