Cyclohexane, 1-butyl-3-ethyl-
TL;DR: Cyclohexane, 1-butyl-3-ethyl- (CAS 54410-99-0) is a chemical compound with molecular formula C12H24 and molecular weight 168.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-3-ethylcyclohexane
Also Known As: 1-Butyl-3-ethylcyclohexane, Cyclohexane, 1-butyl-3-ethyl-, 1-butyl-3-ethyl-cyclohexane, 1-ethyl-3-butyl-cyclohexane, NIOSH/GU7172550
| Molecular Formula | C12H24 |
|---|---|
| Molecular Weight | 168.19 g/mol |
| LogP | 4.393 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.1878 |
| Heavy Atoms | 12 |
| Complexity | 106.605934 |
Chemical Identifiers
| CAS Number | 54410-99-0 |
|---|---|
| SMILES | CCCCC1CCCC(C1)CC |
Product Overview
Cyclohexane, 1-butyl-3-ethyl- (CAS 54410-99-0), with molecular formula C12H24 and molecular weight 168.19 g/mol. IUPAC: 1-butyl-3-ethylcyclohexane.
Chemical Property Profile of Cyclohexane, 1-butyl-3-ethyl-
Property Insights of Cyclohexane, 1-butyl-3-ethyl-
The XLogP value of 4.393 indicates that Cyclohexane, 1-butyl-3-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, Cyclohexane, 1-butyl-3-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexane, 1-butyl-3-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 Cyclohexane, 1-butyl-3-ethyl-?
The CAS number of Cyclohexane, 1-butyl-3-ethyl- is 54410-99-0.
What is the molecular formula of Cyclohexane, 1-butyl-3-ethyl-?
The molecular formula of Cyclohexane, 1-butyl-3-ethyl- is C12H24.
What is the molecular weight of Cyclohexane, 1-butyl-3-ethyl-?
The molecular weight of Cyclohexane, 1-butyl-3-ethyl- is 168.19 g/mol.
Where can I buy Cyclohexane, 1-butyl-3-ethyl-?
You can request a quote for Cyclohexane, 1-butyl-3-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexane, 1-butyl-3-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexane, 1-butyl-3-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.