Butane, 1-(methylsulfonyl)-
TL;DR: Butane, 1-(methylsulfonyl)- (CAS 7560-59-0) is a chemical compound with molecular formula C5H12O2S and molecular weight 136.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfonylbutane
Also Known As: Sulfone, butyl methyl, Butyl methyl sulfone, methylbutyl sulfone, Butylmethyl sulfone, Butane, 1-(methylsulfonyl)-
| Molecular Formula | C5H12O2S |
|---|---|
| Molecular Weight | 136.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 136.0558 |
| Heavy Atoms | 8 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 7560-59-0 |
|---|---|
| SMILES | CCCCS(=O)(=O)C |
| InChIKey | QRXUXNUNFHPWLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butane, 1-(methylsulfonyl)- (CAS 7560-59-0), with molecular formula C5H12O2S and molecular weight 136.06 g/mol. IUPAC: 1-methylsulfonylbutane.
Chemical Property Profile of Butane, 1-(methylsulfonyl)-
Property Insights of Butane, 1-(methylsulfonyl)-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butane, 1-(methylsulfonyl)-. With a topological polar surface area (TPSA) of 42.5 Ų, Butane, 1-(methylsulfonyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butane, 1-(methylsulfonyl)- 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 Butane, 1-(methylsulfonyl)-?
The CAS number of Butane, 1-(methylsulfonyl)- is 7560-59-0.
What is the molecular formula of Butane, 1-(methylsulfonyl)-?
The molecular formula of Butane, 1-(methylsulfonyl)- is C5H12O2S.
What is the molecular weight of Butane, 1-(methylsulfonyl)-?
The molecular weight of Butane, 1-(methylsulfonyl)- is 136.06 g/mol.
Where can I buy Butane, 1-(methylsulfonyl)-?
You can request a quote for Butane, 1-(methylsulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane, 1-(methylsulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for Butane, 1-(methylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.