Phosphonothioic acid, ethyl-
TL;DR: Phosphonothioic acid, ethyl- (CAS 13991-98-5) is a chemical compound with molecular formula C2H7O2PS and molecular weight 125.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl-dihydroxy-sulfanylidene-λ5-phosphane
Also Known As: Phosphonothioic acid, ethyl-, ethylthiophosphonic acid, ethyl-dihydroxy-sulfanylidene, ethyl-dihydroxy-sulfanylidene-, Ethylphosphonothioic O,O-acid
| Molecular Formula | C2H7O2PS |
|---|---|
| Molecular Weight | 125.99 g/mol |
| LogP | 0.3004 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 125.99044 |
| Heavy Atoms | 6 |
| Complexity | 75.61727 |
Chemical Identifiers
| CAS Number | 13991-98-5 |
|---|---|
| SMILES | CCP(=S)(O)O |
Product Overview
Phosphonothioic acid, ethyl- (CAS 13991-98-5), with molecular formula C2H7O2PS and molecular weight 125.99 g/mol. IUPAC: ethyl-dihydroxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphonothioic acid, ethyl-
Property Insights of Phosphonothioic acid, ethyl-
The XLogP value of 0.3004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonothioic acid, ethyl-. With a topological polar surface area (TPSA) of 40.46 Ų, Phosphonothioic acid, ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonothioic acid, ethyl- 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 Phosphonothioic acid, ethyl-?
The CAS number of Phosphonothioic acid, ethyl- is 13991-98-5.
What is the molecular formula of Phosphonothioic acid, ethyl-?
The molecular formula of Phosphonothioic acid, ethyl- is C2H7O2PS.
What is the molecular weight of Phosphonothioic acid, ethyl-?
The molecular weight of Phosphonothioic acid, ethyl- is 125.99 g/mol.
Where can I buy Phosphonothioic acid, ethyl-?
You can request a quote for Phosphonothioic acid, ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonothioic acid, ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Phosphonothioic acid, ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.