1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene
TL;DR: 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene (CAS 136811-66-0) is a chemical compound with molecular formula C15H13ClS and molecular weight 260.04266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-4-(3-phenylprop-2-enylsulfanyl)benzene
Also Known As: 1-chloro-4-(3-phenylprop-2-enylsulfanyl)benzene, 1-chloro-4-[(3-phenyl-2-propenyl)sulfanyl]benzene
Technical Specifications
| Molecular Formula | C15H13ClS |
| Molecular Weight | 260.04266 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.04266 Da |
| Heavy Atoms | 17 |
| Complexity | 225.0 |
| SMILES | C1=CC=C(C=C1)C=CCSC2=CC=C(C=C2)Cl |
| InChIKey | QYRBZQGNYRVPPI-UHFFFAOYSA-N |
Chemical Property Profile of 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene
Property Insights of 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene
The XLogP value of 5.2 indicates that 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene?
The CAS number of 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene is 136811-66-0.
What is the molecular formula of 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene?
The molecular formula of 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene is C15H13ClS.
What is the molecular weight of 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene?
The molecular weight of 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene is 260.04266 g/mol.
Where can I buy 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene?
You can request a quote for 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene?
Yes, CoreyChem provides custom synthesis services for 1-Chloro-4-(3-phenylprop-2-enylsulfanyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.