(2-Ethylhexyl)carbamodithioic acid
TL;DR: (2-Ethylhexyl)carbamodithioic acid (CAS 22292-12-2) is a chemical compound with molecular formula C9H19NS2 and molecular weight 205.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylhexylcarbamodithioic acid
Also Known As: 2-ethylhexylcarbamodithioic acid, (2-Ethylhexyl)carbamodithioic acid, methanedithioic acid, 2-ethylhexylamino-
| Molecular Formula | C9H19NS2 |
|---|---|
| Molecular Weight | 205.10 g/mol |
| LogP | 3.0071 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 205.09589 |
| Heavy Atoms | 12 |
| Complexity | 125.696945 |
Chemical Identifiers
| CAS Number | 22292-12-2 |
|---|---|
| SMILES | CCCCC(CC)CNC(=S)S |
Product Overview
(2-Ethylhexyl)carbamodithioic acid (CAS 22292-12-2), with molecular formula C9H19NS2 and molecular weight 205.10 g/mol. IUPAC: 2-ethylhexylcarbamodithioic acid.
Chemical Property Profile of (2-Ethylhexyl)carbamodithioic acid
Property Insights of (2-Ethylhexyl)carbamodithioic acid
The XLogP value of 3.0071 indicates that (2-Ethylhexyl)carbamodithioic acid 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-Ethylhexyl)carbamodithioic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Ethylhexyl)carbamodithioic acid has 2 hydrogen bond donor(s) and 1 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 (2-Ethylhexyl)carbamodithioic acid?
The CAS number of (2-Ethylhexyl)carbamodithioic acid is 22292-12-2.
What is the molecular formula of (2-Ethylhexyl)carbamodithioic acid?
The molecular formula of (2-Ethylhexyl)carbamodithioic acid is C9H19NS2.
What is the molecular weight of (2-Ethylhexyl)carbamodithioic acid?
The molecular weight of (2-Ethylhexyl)carbamodithioic acid is 205.10 g/mol.
Where can I buy (2-Ethylhexyl)carbamodithioic acid?
You can request a quote for (2-Ethylhexyl)carbamodithioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Ethylhexyl)carbamodithioic acid?
Yes, KEHONG BIO provides custom synthesis services for (2-Ethylhexyl)carbamodithioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.