Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1)
TL;DR: Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1) (CAS 6321-38-6) is a chemical compound with molecular formula C22H50NO2PS2 and molecular weight 455.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethoxy-sulfanyl-sulfanylidene-λ5-phosphane;octadecan-1-amine
Also Known As: Octathione, O,O-Diethyloctadecylphosphoramidothioate, diethoxy-sulfanyl-sulfanylidene-, o,o-diethyl hydrogen phosphorodithioate- octadecan-1-amine(1:1), diethoxy-sulfanyl-sulfanylidene-lambda5-phosphane;octadecan-1-amine
| Molecular Formula | C22H50NO2PS2 |
|---|---|
| Molecular Weight | 455.30 g/mol |
| LogP | 8.4203 |
| Topological Polar Surface Area | 77.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 20 |
| Exact Mass | 455.30206 |
| Heavy Atoms | 28 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 6321-38-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCN.CCOP(=S)(OCC)S |
| InChIKey | SXYDTQIAIBMCDS-UHFFFAOYSA-N |
Product Overview
Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1) (CAS 6321-38-6), with molecular formula C22H50NO2PS2 and molecular weight 455.30 g/mol. IUPAC: diethoxy-sulfanyl-sulfanylidene-λ5-phosphane;octadecan-1-amine.
Chemical Property Profile of Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1)
Property Insights of Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1)
The XLogP value of 8.4203 indicates that Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1). Following Lipinski's Rule of Five, Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1) has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1)?
The CAS number of Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1) is 6321-38-6.
What is the molecular formula of Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1)?
The molecular formula of Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1) is C22H50NO2PS2.
What is the molecular weight of Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1)?
The molecular weight of Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1) is 455.30 g/mol.
Where can I buy Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1)?
You can request a quote for Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Phosphorodithioic acid, O,O-diethyl ester, compd. with 1-octadecanamine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.