Cyclohexane, ((1-methylpropyl)thio)-
TL;DR: Cyclohexane, ((1-methylpropyl)thio)- (CAS 7133-22-4) is a chemical compound with molecular formula C10H20S and molecular weight 172.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butan-2-ylsulfanylcyclohexane
Also Known As: sec-butyl(cyclohexyl)sulfane, Sulfide, sec-butyl cyclohexyl, s-butyl cyclohexyl sulfide, sec-Butylcyclohexyl sulfide, Cyclohexane, [(1-methylpropyl)thio]-
| Molecular Formula | C10H20S |
|---|---|
| Molecular Weight | 172.13 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 172.12857 |
| Heavy Atoms | 11 |
| Complexity | 95.0 |
Chemical Identifiers
| CAS Number | 7133-22-4 |
|---|---|
| SMILES | CCC(C)SC1CCCCC1 |
| InChIKey | BPQBIKVCRYZWCT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexane, ((1-methylpropyl)thio)- (CAS 7133-22-4), with molecular formula C10H20S and molecular weight 172.13 g/mol. IUPAC: butan-2-ylsulfanylcyclohexane.
Chemical Property Profile of Cyclohexane, ((1-methylpropyl)thio)-
Property Insights of Cyclohexane, ((1-methylpropyl)thio)-
The XLogP value of 4.0 indicates that Cyclohexane, ((1-methylpropyl)thio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Cyclohexane, ((1-methylpropyl)thio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexane, ((1-methylpropyl)thio)- has 0 hydrogen bond donor(s) and 1 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 Cyclohexane, ((1-methylpropyl)thio)-?
The CAS number of Cyclohexane, ((1-methylpropyl)thio)- is 7133-22-4.
What is the molecular formula of Cyclohexane, ((1-methylpropyl)thio)-?
The molecular formula of Cyclohexane, ((1-methylpropyl)thio)- is C10H20S.
What is the molecular weight of Cyclohexane, ((1-methylpropyl)thio)-?
The molecular weight of Cyclohexane, ((1-methylpropyl)thio)- is 172.13 g/mol.
Where can I buy Cyclohexane, ((1-methylpropyl)thio)-?
You can request a quote for Cyclohexane, ((1-methylpropyl)thio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexane, ((1-methylpropyl)thio)-?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexane, ((1-methylpropyl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.