Cyclohexene, 3-(1,1-dimethylethyl)-
TL;DR: Cyclohexene, 3-(1,1-dimethylethyl)- (CAS 14072-87-8) 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.
3-tert-butylcyclohexene
Also Known As: 3-tert-butylcyclohexene, Cyclohexene, 3-(1,1-dimethylethyl)-, 3-tert-Butyl-1-cyclohexene, 3-TERT-BUTYLCYCLOHEX-1-ENE, 3-(1,1-dimethylethyl)cyclohexene
| Molecular Formula | C10H18 |
|---|---|
| Molecular Weight | 138.14 g/mol |
| LogP | 4.0 |
| 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 | 14072-87-8 |
|---|---|
| SMILES | CC(C)(C)C1CCCC=C1 |
| InChIKey | FQOILKXUWLDCJM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexene, 3-(1,1-dimethylethyl)- (CAS 14072-87-8), with molecular formula C10H18 and molecular weight 138.14 g/mol. IUPAC: 3-tert-butylcyclohexene.
Chemical Property Profile of Cyclohexene, 3-(1,1-dimethylethyl)-
Property Insights of Cyclohexene, 3-(1,1-dimethylethyl)-
The XLogP value of 4.0 indicates that Cyclohexene, 3-(1,1-dimethylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Cyclohexene, 3-(1,1-dimethylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexene, 3-(1,1-dimethylethyl)- 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 Cyclohexene, 3-(1,1-dimethylethyl)-?
The CAS number of Cyclohexene, 3-(1,1-dimethylethyl)- is 14072-87-8.
What is the molecular formula of Cyclohexene, 3-(1,1-dimethylethyl)-?
The molecular formula of Cyclohexene, 3-(1,1-dimethylethyl)- is C10H18.
What is the molecular weight of Cyclohexene, 3-(1,1-dimethylethyl)-?
The molecular weight of Cyclohexene, 3-(1,1-dimethylethyl)- is 138.14 g/mol.
Where can I buy Cyclohexene, 3-(1,1-dimethylethyl)-?
You can request a quote for Cyclohexene, 3-(1,1-dimethylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexene, 3-(1,1-dimethylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexene, 3-(1,1-dimethylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.