Benzene, 1-butyl-4-ethyl
TL;DR: Benzene, 1-butyl-4-ethyl (CAS 15181-08-5) is a chemical compound with molecular formula C12H18 and molecular weight 162.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-4-ethylbenzene
Also Known As: 1-butyl-4-ethylbenzene, Benzene, 1-butyl-4-ethyl, Benzene, 1-butyl-4-ethyl-, 1-ethyl-4-butylbenzene, 1-Ethyl-4-n-Butylbenzene
| Molecular Formula | C12H18 |
|---|---|
| Molecular Weight | 162.14 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 162.14085 |
| Heavy Atoms | 12 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 15181-08-5 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)CC |
| InChIKey | UPYBAFFRUZTWFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1-butyl-4-ethyl (CAS 15181-08-5), with molecular formula C12H18 and molecular weight 162.14 g/mol. IUPAC: 1-butyl-4-ethylbenzene.
Chemical Property Profile of Benzene, 1-butyl-4-ethyl
Property Insights of Benzene, 1-butyl-4-ethyl
The XLogP value of 4.6 indicates that Benzene, 1-butyl-4-ethyl 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-ethyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-butyl-4-ethyl 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 Benzene, 1-butyl-4-ethyl?
The CAS number of Benzene, 1-butyl-4-ethyl is 15181-08-5.
What is the molecular formula of Benzene, 1-butyl-4-ethyl?
The molecular formula of Benzene, 1-butyl-4-ethyl is C12H18.
What is the molecular weight of Benzene, 1-butyl-4-ethyl?
The molecular weight of Benzene, 1-butyl-4-ethyl is 162.14 g/mol.
Where can I buy Benzene, 1-butyl-4-ethyl?
You can request a quote for Benzene, 1-butyl-4-ethyl 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-ethyl?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-butyl-4-ethyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.