tert-Butylcyclohexane
TL;DR: tert-Butylcyclohexane (CAS 3178-22-1) is a chemical compound with molecular formula C10H20 and molecular weight 140.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butylcyclohexane
Also Known As: TERT-BUTYLCYCLOHEXANE, t-Butylcyclohexane, tert-Butylbenzene, Cyclohexane, tert-butyl-, 1-tert-Butylcyclohexane
| Molecular Formula | C10H20 |
|---|---|
| Molecular Weight | 140.16 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.1565 |
| Heavy Atoms | 10 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 3178-22-1 |
|---|---|
| SMILES | CC(C)(C)C1CCCCC1 |
| InChIKey | XTVMZZBLCLWBPM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
tert-Butylcyclohexane (CAS 3178-22-1), with molecular formula C10H20 and molecular weight 140.16 g/mol. IUPAC: tert-butylcyclohexane.
Chemical Property Profile of tert-Butylcyclohexane
Property Insights of tert-Butylcyclohexane
The XLogP value of 4.7 indicates that tert-Butylcyclohexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, tert-Butylcyclohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butylcyclohexane 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 tert-Butylcyclohexane?
The CAS number of tert-Butylcyclohexane is 3178-22-1.
What is the molecular formula of tert-Butylcyclohexane?
The molecular formula of tert-Butylcyclohexane is C10H20.
What is the molecular weight of tert-Butylcyclohexane?
The molecular weight of tert-Butylcyclohexane is 140.16 g/mol.
Where can I buy tert-Butylcyclohexane?
You can request a quote for tert-Butylcyclohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butylcyclohexane?
Yes, KEHONG BIO provides custom synthesis services for tert-Butylcyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.