4-Ethylstyrene
TL;DR: 4-Ethylstyrene (CAS 3454-07-7) is a chemical compound with molecular formula C10H12 and molecular weight 132.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethenyl-4-ethylbenzene
Also Known As: 4-ETHYLSTYRENE, 1-Ethenyl-4-ethylbenzene, 1-Ethyl-4-vinylbenzene, p-Ethylstyrene, p-Ethylvinylbenzene
| Molecular Formula | C10H12 |
|---|---|
| Molecular Weight | 132.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 132.0939 |
| Heavy Atoms | 10 |
| Complexity | 96.0 |
Chemical Identifiers
| CAS Number | 3454-07-7 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C=C |
| InChIKey | WHFHDVDXYKOSKI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Ethylstyrene (CAS 3454-07-7), with molecular formula C10H12 and molecular weight 132.09 g/mol. IUPAC: 1-ethenyl-4-ethylbenzene.
Chemical Property Profile of 4-Ethylstyrene
Property Insights of 4-Ethylstyrene
The XLogP value of 3.5 indicates that 4-Ethylstyrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4-Ethylstyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethylstyrene has 0 hydrogen bond donor(s) and 0 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 4-Ethylstyrene?
The CAS number of 4-Ethylstyrene is 3454-07-7.
What is the molecular formula of 4-Ethylstyrene?
The molecular formula of 4-Ethylstyrene is C10H12.
What is the molecular weight of 4-Ethylstyrene?
The molecular weight of 4-Ethylstyrene is 132.09 g/mol.
Where can I buy 4-Ethylstyrene?
You can request a quote for 4-Ethylstyrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethylstyrene?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethylstyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.