Carbanilic acid, dithio-p-ethoxy-, methyl ester
TL;DR: Carbanilic acid, dithio-p-ethoxy-, methyl ester (CAS 13037-23-5) is a chemical compound with molecular formula C10H13NOS2 and molecular weight 227.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(4-ethoxyphenyl)carbamodithioate
Also Known As: Methyl dithio-p-ethoxycarbanilate, Dithio-p-ethoxycarbanilic acid methyl ester, methyl (4-ethoxyphenyl)carbamodithioate, methyl 4-ethoxyphenyldithiocarbamate, CARBANILIC ACID, DITHIO-p-ETHOXY-, METHYL ESTER
| Molecular Formula | C10H13NOS2 |
|---|---|
| Molecular Weight | 227.04 g/mol |
| LogP | 3.1451 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.04385 |
| Heavy Atoms | 14 |
| Complexity | 297.49524 |
Chemical Identifiers
| CAS Number | 13037-23-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=S)SC |
Product Overview
Carbanilic acid, dithio-p-ethoxy-, methyl ester (CAS 13037-23-5), with molecular formula C10H13NOS2 and molecular weight 227.04 g/mol. IUPAC: methyl N-(4-ethoxyphenyl)carbamodithioate.
Chemical Property Profile of Carbanilic acid, dithio-p-ethoxy-, methyl ester
Property Insights of Carbanilic acid, dithio-p-ethoxy-, methyl ester
The XLogP value of 3.1451 indicates that Carbanilic acid, dithio-p-ethoxy-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, Carbanilic acid, dithio-p-ethoxy-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbanilic acid, dithio-p-ethoxy-, methyl ester has 1 hydrogen bond donor(s) and 3 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 Carbanilic acid, dithio-p-ethoxy-, methyl ester?
The CAS number of Carbanilic acid, dithio-p-ethoxy-, methyl ester is 13037-23-5.
What is the molecular formula of Carbanilic acid, dithio-p-ethoxy-, methyl ester?
The molecular formula of Carbanilic acid, dithio-p-ethoxy-, methyl ester is C10H13NOS2.
What is the molecular weight of Carbanilic acid, dithio-p-ethoxy-, methyl ester?
The molecular weight of Carbanilic acid, dithio-p-ethoxy-, methyl ester is 227.04 g/mol.
Where can I buy Carbanilic acid, dithio-p-ethoxy-, methyl ester?
You can request a quote for Carbanilic acid, dithio-p-ethoxy-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbanilic acid, dithio-p-ethoxy-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbanilic acid, dithio-p-ethoxy-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.