1,4-Diisopropyl-1-cyclohexene
TL;DR: 1,4-Diisopropyl-1-cyclohexene (CAS 39000-66-3) is a chemical compound with molecular formula C12H22 and molecular weight 166.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-di(propan-2-yl)cyclohexene
Also Known As: 1,4-Diisopropylcyclohexen, 1,4-DIISOPROPYL-1-CYCLOHEXENE, 1,4-diisopropyl-cyclohexene, 1,4-diisopropylcyclohex-1-ene, 1,4-dipropan-2-ylcyclohexene
| Molecular Formula | C12H22 |
|---|---|
| Molecular Weight | 166.17 g/mol |
| LogP | 4.0249 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.17215 |
| Heavy Atoms | 12 |
| Complexity | 162.87712 |
Chemical Identifiers
| CAS Number | 39000-66-3 |
|---|---|
| SMILES | CC(C)C1CCC(=CC1)C(C)C |
Product Overview
1,4-Diisopropyl-1-cyclohexene (CAS 39000-66-3), with molecular formula C12H22 and molecular weight 166.17 g/mol. IUPAC: 1,4-di(propan-2-yl)cyclohexene.
Chemical Property Profile of 1,4-Diisopropyl-1-cyclohexene
Property Insights of 1,4-Diisopropyl-1-cyclohexene
The XLogP value of 4.0249 indicates that 1,4-Diisopropyl-1-cyclohexene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,4-Diisopropyl-1-cyclohexene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Diisopropyl-1-cyclohexene 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 1,4-Diisopropyl-1-cyclohexene?
The CAS number of 1,4-Diisopropyl-1-cyclohexene is 39000-66-3.
What is the molecular formula of 1,4-Diisopropyl-1-cyclohexene?
The molecular formula of 1,4-Diisopropyl-1-cyclohexene is C12H22.
What is the molecular weight of 1,4-Diisopropyl-1-cyclohexene?
The molecular weight of 1,4-Diisopropyl-1-cyclohexene is 166.17 g/mol.
Where can I buy 1,4-Diisopropyl-1-cyclohexene?
You can request a quote for 1,4-Diisopropyl-1-cyclohexene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Diisopropyl-1-cyclohexene?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Diisopropyl-1-cyclohexene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.