Velsicol 58-CS-39
TL;DR: Velsicol 58-CS-39 (CAS 37361-82-3) is a chemical compound with molecular formula C14H26O8P2S4 and molecular weight 512.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-(2-dimethoxyphosphinothioylsulfanylpropyl) 4-O-prop-2-enyl 2-dimethoxyphosphinothioylsulfanylbutanedioate
Also Known As: Velsicol 58-CS-39, Velsicol-58CS-39, ENT 25,620, AI3-25620, 1-{2-[(dimethoxyphosphorothioyl)sulfanyl]propyl} 4-prop-2-en-1-yl 2-[(dimethoxyphosphorothioyl)sulfanyl]butanedioate
| Molecular Formula | C14H26O8P2S4 |
|---|---|
| Molecular Weight | 512.00 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 204.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 17 |
| Exact Mass | 511.99857 |
| Heavy Atoms | 28 |
| Complexity | 602.0 |
Chemical Identifiers
| CAS Number | 37361-82-3 |
|---|---|
| SMILES | CC(COC(=O)C(CC(=O)OCC=C)SP(=S)(OC)OC)SP(=S)(OC)OC |
| InChIKey | MSCUHXPWGRRKKL-UHFFFAOYSA-N |
Product Overview
Velsicol 58-CS-39 (CAS 37361-82-3), with molecular formula C14H26O8P2S4 and molecular weight 512.00 g/mol. IUPAC: 1-O-(2-dimethoxyphosphinothioylsulfanylpropyl) 4-O-prop-2-enyl 2-dimethoxyphosphinothioylsulfanylbutanedioate.
Chemical Property Profile of Velsicol 58-CS-39
Property Insights of Velsicol 58-CS-39
The XLogP value of 4.1 indicates that Velsicol 58-CS-39 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 204.0 Ų indicates high polarity, suggesting Velsicol 58-CS-39 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Velsicol 58-CS-39 has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Velsicol 58-CS-39?
The CAS number of Velsicol 58-CS-39 is 37361-82-3.
What is the molecular formula of Velsicol 58-CS-39?
The molecular formula of Velsicol 58-CS-39 is C14H26O8P2S4.
What is the molecular weight of Velsicol 58-CS-39?
The molecular weight of Velsicol 58-CS-39 is 512.00 g/mol.
Where can I buy Velsicol 58-CS-39?
You can request a quote for Velsicol 58-CS-39 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Velsicol 58-CS-39?
Yes, KEHONG BIO provides custom synthesis services for Velsicol 58-CS-39 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.