异戊烯基苯基硫醚
TL;DR: 异戊烯基苯基硫醚 (CAS 10276-04-7) is a chemical compound with molecular formula C11H14S and molecular weight 178.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异戊烯基苯基硫醚
3-methylbut-2-enylsulfanylbenzene
Also Known As: Prenylphenyl sulfide, Phenyl prenyl sulfide, 3-methylbut-2-enylsulfanylbenzene, Isopentenylphenyl sulfide, Phenylisopentenyl sulfide
| Molecular Formula | C11H14S |
|---|---|
| Molecular Weight | 178.08 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 178.08162 |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 10276-04-7 |
|---|---|
| SMILES | CC(=CCSC1=CC=CC=C1)C |
| InChIKey | NYZWUNJQCIIVSA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
异戊烯基苯基硫醚 (CAS 10276-04-7), with molecular formula C11H14S and molecular weight 178.08 g/mol. IUPAC: 3-methylbut-2-enylsulfanylbenzene.
Chemical Property Profile of 异戊烯基苯基硫醚
Property Insights of 异戊烯基苯基硫醚
The XLogP value of 4.4 indicates that 异戊烯基苯基硫醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 异戊烯基苯基硫醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 异戊烯基苯基硫醚 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 异戊烯基苯基硫醚?
The CAS number of 异戊烯基苯基硫醚 is 10276-04-7.
What is the molecular formula of 异戊烯基苯基硫醚?
The molecular formula of 异戊烯基苯基硫醚 is C11H14S.
What is the molecular weight of 异戊烯基苯基硫醚?
The molecular weight of 异戊烯基苯基硫醚 is 178.08 g/mol.
Where can I buy 异戊烯基苯基硫醚?
You can request a quote for 异戊烯基苯基硫醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异戊烯基苯基硫醚?
Yes, KEHONG BIO provides custom synthesis services for 异戊烯基苯基硫醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.