O,O-Diheptyl dithiophosphoric acid
TL;DR: O,O-Diheptyl dithiophosphoric acid (CAS 2253-56-7) is a chemical compound with molecular formula C14H31O2PS2 and molecular weight 326.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diheptoxy-sulfanyl-sulfanylidene-λ5-phosphane
Also Known As: Heptyl phosphorodithioate, O,O-Diheptyl dithiophosphoric acid, diheptyl dithiophosphoric acid, diheptoxy-sulfanyl-sulfanylidene-, Phosphorodithioic acid, O,O-diheptyl ester
| Molecular Formula | C14H31O2PS2 |
|---|---|
| Molecular Weight | 326.15 g/mol |
| LogP | 6.1147 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 14 |
| Exact Mass | 326.1503 |
| Heavy Atoms | 19 |
| Complexity | 217.48586 |
Chemical Identifiers
| CAS Number | 2253-56-7 |
|---|---|
| SMILES | CCCCCCCOP(=S)(OCCCCCCC)S |
Product Overview
O,O-Diheptyl dithiophosphoric acid (CAS 2253-56-7), with molecular formula C14H31O2PS2 and molecular weight 326.15 g/mol. IUPAC: diheptoxy-sulfanyl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of O,O-Diheptyl dithiophosphoric acid
Property Insights of O,O-Diheptyl dithiophosphoric acid
The XLogP value of 6.1147 indicates that O,O-Diheptyl dithiophosphoric acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.46 Ų, O,O-Diheptyl dithiophosphoric acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O,O-Diheptyl dithiophosphoric acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of O,O-Diheptyl dithiophosphoric acid?
The CAS number of O,O-Diheptyl dithiophosphoric acid is 2253-56-7.
What is the molecular formula of O,O-Diheptyl dithiophosphoric acid?
The molecular formula of O,O-Diheptyl dithiophosphoric acid is C14H31O2PS2.
What is the molecular weight of O,O-Diheptyl dithiophosphoric acid?
The molecular weight of O,O-Diheptyl dithiophosphoric acid is 326.15 g/mol.
Where can I buy O,O-Diheptyl dithiophosphoric acid?
You can request a quote for O,O-Diheptyl dithiophosphoric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O,O-Diheptyl dithiophosphoric acid?
Yes, KEHONG BIO provides custom synthesis services for O,O-Diheptyl dithiophosphoric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.