1-(2-Methylpropane-2-sulfonyl)prop-1-yne
TL;DR: 1-(2-Methylpropane-2-sulfonyl)prop-1-yne (CAS 56480-91-2) is a chemical compound with molecular formula C7H12O2S and molecular weight 160.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-prop-1-ynylsulfonylpropane
Also Known As: 2-methyl-2-prop-1-ynylsulfonylpropane, 1-(2-Methylpropane-2-sulfonyl)prop-1-yne, 2-methyl-2-prop-1-ynylsulfonyl-propane
| Molecular Formula | C7H12O2S |
|---|---|
| Molecular Weight | 160.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.0558 |
| Heavy Atoms | 10 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 56480-91-2 |
|---|---|
| SMILES | CC#CS(=O)(=O)C(C)(C)C |
| InChIKey | YOLHITBEVLNXRU-UHFFFAOYSA-N |
Product Overview
1-(2-Methylpropane-2-sulfonyl)prop-1-yne (CAS 56480-91-2), with molecular formula C7H12O2S and molecular weight 160.06 g/mol. IUPAC: 2-methyl-2-prop-1-ynylsulfonylpropane.
Chemical Property Profile of 1-(2-Methylpropane-2-sulfonyl)prop-1-yne
Property Insights of 1-(2-Methylpropane-2-sulfonyl)prop-1-yne
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Methylpropane-2-sulfonyl)prop-1-yne. With a topological polar surface area (TPSA) of 42.5 Ų, 1-(2-Methylpropane-2-sulfonyl)prop-1-yne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Methylpropane-2-sulfonyl)prop-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-(2-Methylpropane-2-sulfonyl)prop-1-yne?
The CAS number of 1-(2-Methylpropane-2-sulfonyl)prop-1-yne is 56480-91-2.
What is the molecular formula of 1-(2-Methylpropane-2-sulfonyl)prop-1-yne?
The molecular formula of 1-(2-Methylpropane-2-sulfonyl)prop-1-yne is C7H12O2S.
What is the molecular weight of 1-(2-Methylpropane-2-sulfonyl)prop-1-yne?
The molecular weight of 1-(2-Methylpropane-2-sulfonyl)prop-1-yne is 160.06 g/mol.
Where can I buy 1-(2-Methylpropane-2-sulfonyl)prop-1-yne?
You can request a quote for 1-(2-Methylpropane-2-sulfonyl)prop-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-(2-Methylpropane-2-sulfonyl)prop-1-yne?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Methylpropane-2-sulfonyl)prop-1-yne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.