1-Prop-1-ynylsulfinylprop-1-yne
TL;DR: 1-Prop-1-ynylsulfinylprop-1-yne (CAS 68634-33-3) is a chemical compound with molecular formula C6H6OS and molecular weight 126.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-prop-1-ynylsulfinylprop-1-yne
Also Known As: propynyl sulfoxide, 1-prop-1-ynylsulfinylprop-1-yne, di-prop-1-ynyl sulfoxide, 1-(PROP-1-YNE-1-SULFINYL)PROP-1-YNE, RefChem:234475
| Molecular Formula | C6H6OS |
|---|---|
| Molecular Weight | 126.01 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 126.01394 |
| Heavy Atoms | 8 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 68634-33-3 |
|---|---|
| SMILES | CC#CS(=O)C#CC |
| InChIKey | KRZQPAOKLDETSZ-UHFFFAOYSA-N |
Product Overview
1-Prop-1-ynylsulfinylprop-1-yne (CAS 68634-33-3), with molecular formula C6H6OS and molecular weight 126.01 g/mol. IUPAC: 1-prop-1-ynylsulfinylprop-1-yne.
Chemical Property Profile of 1-Prop-1-ynylsulfinylprop-1-yne
Property Insights of 1-Prop-1-ynylsulfinylprop-1-yne
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Prop-1-ynylsulfinylprop-1-yne. With a topological polar surface area (TPSA) of 36.3 Ų, 1-Prop-1-ynylsulfinylprop-1-yne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Prop-1-ynylsulfinylprop-1-yne has 0 hydrogen bond donor(s) and 2 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 1-Prop-1-ynylsulfinylprop-1-yne?
The CAS number of 1-Prop-1-ynylsulfinylprop-1-yne is 68634-33-3.
What is the molecular formula of 1-Prop-1-ynylsulfinylprop-1-yne?
The molecular formula of 1-Prop-1-ynylsulfinylprop-1-yne is C6H6OS.
What is the molecular weight of 1-Prop-1-ynylsulfinylprop-1-yne?
The molecular weight of 1-Prop-1-ynylsulfinylprop-1-yne is 126.01 g/mol.
Where can I buy 1-Prop-1-ynylsulfinylprop-1-yne?
You can request a quote for 1-Prop-1-ynylsulfinylprop-1-yne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Prop-1-ynylsulfinylprop-1-yne?
Yes, KEHONG BIO provides custom synthesis services for 1-Prop-1-ynylsulfinylprop-1-yne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.