![Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]- structure](/static/products/1173/117392-63-9.webp)
Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]-
TL;DR: Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]- (CAS 117392-63-9) is a chemical compound with molecular formula C20H22 and molecular weight 262.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-4-[2-(4-ethylphenyl)ethynyl]benzene
Also Known As: Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]-, 1-butyl-4-[2-(4-ethylphenyl)ethynyl]benzene, 1-Butyl-4-[(4-ethylphenyl)ethynyl]benzene, Benzene,1-butyl-4-[(4-ethylphenyl)ethynyl]- (9CI), 1-Butyl-4-[(4-ethylphenyl)ethynyl]benzene #
| Molecular Formula | C20H22 |
|---|---|
| Molecular Weight | 262.17 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 262.17215 |
| Heavy Atoms | 20 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 117392-63-9 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)CC |
| InChIKey | FEWCQIVPFKPBDH-UHFFFAOYSA-N |
Product Overview
Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]- (CAS 117392-63-9), with molecular formula C20H22 and molecular weight 262.17 g/mol. IUPAC: 1-butyl-4-[2-(4-ethylphenyl)ethynyl]benzene.
Chemical Property Profile of Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]-
Property Insights of Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]-
The XLogP value of 6.6 indicates that Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]-?
The CAS number of Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]- is 117392-63-9.
What is the molecular formula of Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]-?
The molecular formula of Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]- is C20H22.
What is the molecular weight of Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]-?
The molecular weight of Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]- is 262.17 g/mol.
Where can I buy Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]-?
You can request a quote for Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.