3-Methylbutylcyclohexane
TL;DR: 3-Methylbutylcyclohexane (CAS 54105-76-9) is a chemical compound with molecular formula C11H22 and molecular weight 154.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylbutylcyclohexane
Also Known As: 3-methylbutylcyclohexane, Cyclohexane, (3-methylbutyl)-, 4-cyclohexyl-2-methylbutane, (3-methyl-butyl)-cyclohexane, (3-METHYLBUTYL)CYCLOHEXANE
| Molecular Formula | C11H22 |
|---|---|
| Molecular Weight | 154.17 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 154.17215 |
| Heavy Atoms | 11 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 54105-76-9 |
|---|---|
| SMILES | CC(C)CCC1CCCCC1 |
| InChIKey | BBCIDAVDQLJDMP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methylbutylcyclohexane (CAS 54105-76-9), with molecular formula C11H22 and molecular weight 154.17 g/mol. IUPAC: 3-methylbutylcyclohexane.
Chemical Property Profile of 3-Methylbutylcyclohexane
Property Insights of 3-Methylbutylcyclohexane
The XLogP value of 5.4 indicates that 3-Methylbutylcyclohexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Methylbutylcyclohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylbutylcyclohexane 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 3-Methylbutylcyclohexane?
The CAS number of 3-Methylbutylcyclohexane is 54105-76-9.
What is the molecular formula of 3-Methylbutylcyclohexane?
The molecular formula of 3-Methylbutylcyclohexane is C11H22.
What is the molecular weight of 3-Methylbutylcyclohexane?
The molecular weight of 3-Methylbutylcyclohexane is 154.17 g/mol.
Where can I buy 3-Methylbutylcyclohexane?
You can request a quote for 3-Methylbutylcyclohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylbutylcyclohexane?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylbutylcyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.