(2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate
TL;DR: (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate (CAS 93408-99-2) is a chemical compound with molecular formula C8H4Cl5NS2 and molecular weight 352.82 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate
Also Known As: Pentachlorophenyl methylcarbamodithioate, (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate, Carbamodithioic acid, methyl-, pentachlorophenyl ester
| Molecular Formula | C8H4Cl5NS2 |
|---|---|
| Molecular Weight | 352.82 g/mol |
| LogP | 5.55 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 352.82278 |
| Heavy Atoms | 16 |
| Complexity | 419.5402 |
Chemical Identifiers
| CAS Number | 93408-99-2 |
|---|---|
| SMILES | CNC(=S)SC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl |
Product Overview
(2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate (CAS 93408-99-2), with molecular formula C8H4Cl5NS2 and molecular weight 352.82 g/mol. IUPAC: (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate.
Chemical Property Profile of (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate
Property Insights of (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate
The XLogP value of 5.55 indicates that (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate?
The CAS number of (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate is 93408-99-2.
What is the molecular formula of (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate?
The molecular formula of (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate is C8H4Cl5NS2.
What is the molecular weight of (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate?
The molecular weight of (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate is 352.82 g/mol.
Where can I buy (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate?
You can request a quote for (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate?
Yes, KEHONG BIO provides custom synthesis services for (2,3,4,5,6-pentachlorophenyl) N-methylcarbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.