Sulfurous acid, bis(2-propynyl) ester
TL;DR: Sulfurous acid, bis(2-propynyl) ester (CAS 1899-25-8) is a chemical compound with molecular formula C6H6O3S and molecular weight 158.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(prop-2-ynyl) sulfite
Also Known As: Propargylsulfit, bis(prop-2-ynyl) sulfite, Di-2-propynyl sulfite, diprop-2-yn-1-yl sulfite, Sulfurous acid, bis(2-propynyl) ester
| Molecular Formula | C6H6O3S |
|---|---|
| Molecular Weight | 158.00 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 158.00377 |
| Heavy Atoms | 10 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 1899-25-8 |
|---|---|
| SMILES | C#CCOS(=O)OCC#C |
| InChIKey | IBFKUDZISVEAJN-UHFFFAOYSA-N |
Product Overview
Sulfurous acid, bis(2-propynyl) ester (CAS 1899-25-8), with molecular formula C6H6O3S and molecular weight 158.00 g/mol. IUPAC: bis(prop-2-ynyl) sulfite.
Chemical Property Profile of Sulfurous acid, bis(2-propynyl) ester
Property Insights of Sulfurous acid, bis(2-propynyl) ester
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulfurous acid, bis(2-propynyl) ester. With a topological polar surface area (TPSA) of 54.7 Ų, Sulfurous acid, bis(2-propynyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sulfurous acid, bis(2-propynyl) ester has 0 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 Sulfurous acid, bis(2-propynyl) ester?
The CAS number of Sulfurous acid, bis(2-propynyl) ester is 1899-25-8.
What is the molecular formula of Sulfurous acid, bis(2-propynyl) ester?
The molecular formula of Sulfurous acid, bis(2-propynyl) ester is C6H6O3S.
What is the molecular weight of Sulfurous acid, bis(2-propynyl) ester?
The molecular weight of Sulfurous acid, bis(2-propynyl) ester is 158.00 g/mol.
Where can I buy Sulfurous acid, bis(2-propynyl) ester?
You can request a quote for Sulfurous acid, bis(2-propynyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfurous acid, bis(2-propynyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Sulfurous acid, bis(2-propynyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.