Sulfide, allyl pentyl
TL;DR: Sulfide, allyl pentyl (CAS 3393-13-3) is a chemical compound with molecular formula C8H16S and molecular weight 144.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-prop-2-enylsulfanylpentane
Also Known As: Sulfide, allyl pentyl, 4-thia-1-nonene, Allyl pentyl sulfide, Pentylallyl sulfide, 1-prop-2-enylsulfanylpentane
| Molecular Formula | C8H16S |
|---|---|
| Molecular Weight | 144.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 144.09727 |
| Heavy Atoms | 9 |
| Complexity | 59.0 |
Chemical Identifiers
| CAS Number | 3393-13-3 |
|---|---|
| SMILES | CCCCCSCC=C |
| InChIKey | AMSGWDQTSUNZMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sulfide, allyl pentyl (CAS 3393-13-3), with molecular formula C8H16S and molecular weight 144.10 g/mol. IUPAC: 1-prop-2-enylsulfanylpentane.
Chemical Property Profile of Sulfide, allyl pentyl
Property Insights of Sulfide, allyl pentyl
The XLogP value of 3.3 indicates that Sulfide, allyl pentyl 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, allyl pentyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sulfide, allyl pentyl 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, allyl pentyl?
The CAS number of Sulfide, allyl pentyl is 3393-13-3.
What is the molecular formula of Sulfide, allyl pentyl?
The molecular formula of Sulfide, allyl pentyl is C8H16S.
What is the molecular weight of Sulfide, allyl pentyl?
The molecular weight of Sulfide, allyl pentyl is 144.10 g/mol.
Where can I buy Sulfide, allyl pentyl?
You can request a quote for Sulfide, allyl pentyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfide, allyl pentyl?
Yes, KEHONG BIO provides custom synthesis services for Sulfide, allyl pentyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.