Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester
TL;DR: Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester (CAS 64048-13-1) is a chemical compound with molecular formula C6H16O5P2S2 and molecular weight 293.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethoxyphosphinothioyloxy-dimethoxy-sulfanylidene-λ5-phosphane
Also Known As: P-Diethyl P'-dimethyl thiopyrophosphate, o,o-diethyl o,o-dimethyl dithiodiphosphate, Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester, diethoxyphosphinothioyloxy-dimethoxy-sulfanylidene-, Thiodiphosphoric acid ([(HO)2P(S)]2O), P,P-diethyl P',P'-dimethyl ester
| Molecular Formula | C6H16O5P2S2 |
|---|---|
| Molecular Weight | 293.99 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 293.99146 |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 64048-13-1 |
|---|---|
| SMILES | CCOP(=S)(OCC)OP(=S)(OC)OC |
| InChIKey | VDWHIZGTRITZOX-UHFFFAOYSA-N |
Product Overview
Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester (CAS 64048-13-1), with molecular formula C6H16O5P2S2 and molecular weight 293.99 g/mol. IUPAC: diethoxyphosphinothioyloxy-dimethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester
Property Insights of Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester
The XLogP value of 3.1 indicates that Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester. Following Lipinski's Rule of Five, Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester has 0 hydrogen bond donor(s) and 7 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 Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester?
The CAS number of Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester is 64048-13-1.
What is the molecular formula of Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester?
The molecular formula of Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester is C6H16O5P2S2.
What is the molecular weight of Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester?
The molecular weight of Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester is 293.99 g/mol.
Where can I buy Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester?
You can request a quote for Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Thiopyrophosphoric acid, P-(diethyl) P'-(dimethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.