3-Phenylprop-2-enylsulfanylbenzene
TL;DR: 3-Phenylprop-2-enylsulfanylbenzene (CAS 5848-60-2) is a chemical compound with molecular formula C15H14S and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylprop-2-enylsulfanylbenzene
Also Known As: 3-phenylprop-2-enylsulfanylbenzene, Benzene, [(3-phenyl-2-propenyl)thio]-, 1-[3-(phenylsulfanyl)-1-propenyl]benzene, Benzene, [[(2E)-3-phenyl-2-propenyl]thio]-
| Molecular Formula | C15H14S |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 226.08162 |
| Heavy Atoms | 16 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 5848-60-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CCSC2=CC=CC=C2 |
| InChIKey | FEHPZIJSLMHZSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Phenylprop-2-enylsulfanylbenzene (CAS 5848-60-2), with molecular formula C15H14S and molecular weight 226.08 g/mol. IUPAC: 3-phenylprop-2-enylsulfanylbenzene.
Chemical Property Profile of 3-Phenylprop-2-enylsulfanylbenzene
Property Insights of 3-Phenylprop-2-enylsulfanylbenzene
The XLogP value of 4.6 indicates that 3-Phenylprop-2-enylsulfanylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 3-Phenylprop-2-enylsulfanylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenylprop-2-enylsulfanylbenzene 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 3-Phenylprop-2-enylsulfanylbenzene?
The CAS number of 3-Phenylprop-2-enylsulfanylbenzene is 5848-60-2.
What is the molecular formula of 3-Phenylprop-2-enylsulfanylbenzene?
The molecular formula of 3-Phenylprop-2-enylsulfanylbenzene is C15H14S.
What is the molecular weight of 3-Phenylprop-2-enylsulfanylbenzene?
The molecular weight of 3-Phenylprop-2-enylsulfanylbenzene is 226.08 g/mol.
Where can I buy 3-Phenylprop-2-enylsulfanylbenzene?
You can request a quote for 3-Phenylprop-2-enylsulfanylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenylprop-2-enylsulfanylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenylprop-2-enylsulfanylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.