Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester
TL;DR: Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester (CAS 63980-90-5) is a chemical compound with molecular formula C9H11O4PS and molecular weight 246.01157 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[methoxy(prop-2-ynylsulfanyl)phosphoryl]oxymethyl]furan
Also Known As: O-(Furfur-2-yl) O-methyl S-(prop-2'-ynyl) phosphorothioate, 2-[[methoxy(prop-2-ynylsulfanyl)phosphoryl]oxymethyl]furan, Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester, Thiophosphoric acid O-furfuryl O-methyl S-(2-propynyl) ester, o-(furan-2-ylmethyl) o-methyls-prop-2-yn-1-yl phosphorothioate
Technical Specifications
| Molecular Formula | C9H11O4PS |
| Molecular Weight | 246.01157 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 74.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 246.01157 Da |
| Heavy Atoms | 15 |
| Complexity | 285.0 |
| SMILES | COP(=O)(OCC1=CC=CO1)SCC#C |
| InChIKey | KMWWEQFDLQMBAC-UHFFFAOYSA-N |
Chemical Property Profile of Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester
Property Insights of Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester. Following Lipinski's Rule of Five, Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester?
The CAS number of Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester is 63980-90-5.
What is the molecular formula of Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester?
The molecular formula of Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester is C9H11O4PS.
What is the molecular weight of Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester?
The molecular weight of Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester is 246.01157 g/mol.
Where can I buy Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester?
You can request a quote for Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester?
Yes, CoreyChem provides custom synthesis services for Phosphorothioic acid, O-(furfur-2-yl) O-methyl S-(prop-2'-ynyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.