3-Methylene-1,5,5-trimethylcyclohexene
TL;DR: 3-Methylene-1,5,5-trimethylcyclohexene (CAS 16609-28-2) is a chemical compound with molecular formula C10H16 and molecular weight 136.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5,5-trimethyl-3-methylidenecyclohexene
Also Known As: 3-Methylene-1,5,5-trimethylcyclohexene, 1,5,5-trimethyl-3-methylidenecyclohexene, Cyclohexene, 1,5,5-trimethyl-3-methylene-, 3-METHYLENE 1,5,5-TRIMETHYL CYCLOHEXENE-1, 3-methylene-1,5,5-trimethyl cyclohexene
| Molecular Formula | C10H16 |
|---|---|
| Molecular Weight | 136.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.1252 |
| Heavy Atoms | 10 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 16609-28-2 |
|---|---|
| SMILES | CC1=CC(=C)CC(C1)(C)C |
| InChIKey | ZKXYHQFGFMZPPJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methylene-1,5,5-trimethylcyclohexene (CAS 16609-28-2), with molecular formula C10H16 and molecular weight 136.13 g/mol. IUPAC: 1,5,5-trimethyl-3-methylidenecyclohexene.
Chemical Property Profile of 3-Methylene-1,5,5-trimethylcyclohexene
Property Insights of 3-Methylene-1,5,5-trimethylcyclohexene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methylene-1,5,5-trimethylcyclohexene. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Methylene-1,5,5-trimethylcyclohexene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylene-1,5,5-trimethylcyclohexene 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 3-Methylene-1,5,5-trimethylcyclohexene?
The CAS number of 3-Methylene-1,5,5-trimethylcyclohexene is 16609-28-2.
What is the molecular formula of 3-Methylene-1,5,5-trimethylcyclohexene?
The molecular formula of 3-Methylene-1,5,5-trimethylcyclohexene is C10H16.
What is the molecular weight of 3-Methylene-1,5,5-trimethylcyclohexene?
The molecular weight of 3-Methylene-1,5,5-trimethylcyclohexene is 136.13 g/mol.
Where can I buy 3-Methylene-1,5,5-trimethylcyclohexene?
You can request a quote for 3-Methylene-1,5,5-trimethylcyclohexene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylene-1,5,5-trimethylcyclohexene?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylene-1,5,5-trimethylcyclohexene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.