Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane
TL;DR: Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane (CAS 44843-57-4) is a chemical compound with molecular formula C4H11O3PS and molecular weight 170.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butan-2-yloxy-dihydroxy-sulfanylidene-λ5-phosphane
Also Known As: Bufos, Mono-S-butyl phosphorothioate, S-Butyl-dihydrogenthiophosphat, Phosphorothioic acid, S-butyl ester, Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane
| Molecular Formula | C4H11O3PS |
|---|---|
| Molecular Weight | 170.02 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.01665 |
| Heavy Atoms | 9 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 44843-57-4 |
|---|---|
| SMILES | CCC(C)OP(=S)(O)O |
| InChIKey | LHZXVGBVOKGIRR-UHFFFAOYSA-N |
Product Overview
Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane (CAS 44843-57-4), with molecular formula C4H11O3PS and molecular weight 170.02 g/mol. IUPAC: butan-2-yloxy-dihydroxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane
Property Insights of Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane. Following Lipinski's Rule of Five, Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane has 2 hydrogen bond donor(s) and 4 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 Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane?
The CAS number of Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane is 44843-57-4.
What is the molecular formula of Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane?
The molecular formula of Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane is C4H11O3PS.
What is the molecular weight of Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane?
The molecular weight of Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane is 170.02 g/mol.
Where can I buy Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane?
You can request a quote for Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane?
Yes, KEHONG BIO provides custom synthesis services for Butan-2-yloxy-dihydroxy-sulfanylidene-phosphorane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.