Sulfide, butyl o-tolyl
TL;DR: Sulfide, butyl o-tolyl (CAS 15560-99-3) is a chemical compound with molecular formula C11H16S and molecular weight 180.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butylsulfanyl-2-methylbenzene
Also Known As: Sulfide, butyl o-tolyl, tolyl-n-butylsulfide, Butyl 2-methylphenyl sulfide, Butyl(o-tolyl) sulfide, 1-butylsulfanyl-2-methylbenzene
| Molecular Formula | C11H16S |
|---|---|
| Molecular Weight | 180.10 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.09727 |
| Heavy Atoms | 12 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 15560-99-3 |
|---|---|
| SMILES | CCCCSC1=CC=CC=C1C |
| InChIKey | RNLYLNHPQLCRFI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sulfide, butyl o-tolyl (CAS 15560-99-3), with molecular formula C11H16S and molecular weight 180.10 g/mol. IUPAC: 1-butylsulfanyl-2-methylbenzene.
Chemical Property Profile of Sulfide, butyl o-tolyl
Property Insights of Sulfide, butyl o-tolyl
The XLogP value of 4.0 indicates that Sulfide, butyl o-tolyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Sulfide, butyl o-tolyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sulfide, butyl o-tolyl 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 Sulfide, butyl o-tolyl?
The CAS number of Sulfide, butyl o-tolyl is 15560-99-3.
What is the molecular formula of Sulfide, butyl o-tolyl?
The molecular formula of Sulfide, butyl o-tolyl is C11H16S.
What is the molecular weight of Sulfide, butyl o-tolyl?
The molecular weight of Sulfide, butyl o-tolyl is 180.10 g/mol.
Where can I buy Sulfide, butyl o-tolyl?
You can request a quote for Sulfide, butyl o-tolyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfide, butyl o-tolyl?
Yes, KEHONG BIO provides custom synthesis services for Sulfide, butyl o-tolyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.