Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)-
TL;DR: Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)- (CAS 85473-34-3) is a chemical compound with molecular formula C9H19O2PS and molecular weight 222.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[methyl(propylsulfanyl)phosphoryl]oxycyclopentane
Also Known As: (+)-Cyclopentyl S-propyl methylphosphonothioate, (-)-Cyclopentyl S-propyl methylphosphonothioate, (+-)-Cyclopentyl S-propyl methylphosphonothioate, (R)-O-Cyclopentyl S-propyl methylphosphonothioate, (S)-O-Cyclopentyl S-propyl methylphosphonothioate
| Molecular Formula | C9H19O2PS |
|---|---|
| Molecular Weight | 222.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 222.08434 |
| Heavy Atoms | 13 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 85473-34-3 |
|---|---|
| SMILES | CCCSP(=O)(C)OC1CCCC1 |
| InChIKey | HQGSMDCBXJCTJI-UHFFFAOYSA-N |
Product Overview
Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)- (CAS 85473-34-3), with molecular formula C9H19O2PS and molecular weight 222.08 g/mol. IUPAC: [methyl(propylsulfanyl)phosphoryl]oxycyclopentane.
Chemical Property Profile of Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)-
Property Insights of Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)-. With a topological polar surface area (TPSA) of 51.6 Ų, Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)- has 0 hydrogen bond donor(s) and 3 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, methyl-, O-cyclopentyl S-propyl ester, (+-)-?
The CAS number of Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)- is 85473-34-3.
What is the molecular formula of Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)-?
The molecular formula of Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)- is C9H19O2PS.
What is the molecular weight of Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)-?
The molecular weight of Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)- is 222.08 g/mol.
Where can I buy Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)-?
You can request a quote for Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)-?
Yes, KEHONG BIO provides custom synthesis services for Phosphonothioic acid, methyl-, O-cyclopentyl S-propyl ester, (+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.