4-Tert-butylcyclohex-1-ene
TL;DR: 4-Tert-butylcyclohex-1-ene (CAS 2228-98-0) is a chemical compound with molecular formula C10H18 and molecular weight 138.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butylcyclohexene
Also Known As: 4-(tert-Butyl)cyclohex-1-ene, 4-tert-Butylcyclohexene, 4-tert-butylcyclohex-1-ene, 4-tert-Butyl-1-cyclohexene, Cyclohexene, 4-tert-butyl-
| Molecular Formula | C10H18 |
|---|---|
| Molecular Weight | 138.14 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 138.14085 |
| Heavy Atoms | 10 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 2228-98-0 |
|---|---|
| SMILES | CC(C)(C)C1CCC=CC1 |
| InChIKey | PJTMQLHFQYFBBB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Tert-butylcyclohex-1-ene (CAS 2228-98-0), with molecular formula C10H18 and molecular weight 138.14 g/mol. IUPAC: 4-tert-butylcyclohexene.
Chemical Property Profile of 4-Tert-butylcyclohex-1-ene
Property Insights of 4-Tert-butylcyclohex-1-ene
The XLogP value of 3.9 indicates that 4-Tert-butylcyclohex-1-ene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4-Tert-butylcyclohex-1-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butylcyclohex-1-ene 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 4-Tert-butylcyclohex-1-ene?
The CAS number of 4-Tert-butylcyclohex-1-ene is 2228-98-0.
What is the molecular formula of 4-Tert-butylcyclohex-1-ene?
The molecular formula of 4-Tert-butylcyclohex-1-ene is C10H18.
What is the molecular weight of 4-Tert-butylcyclohex-1-ene?
The molecular weight of 4-Tert-butylcyclohex-1-ene is 138.14 g/mol.
Where can I buy 4-Tert-butylcyclohex-1-ene?
You can request a quote for 4-Tert-butylcyclohex-1-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Tert-butylcyclohex-1-ene?
Yes, KEHONG BIO provides custom synthesis services for 4-Tert-butylcyclohex-1-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.