3-Methyl-1,5-cyclooctadiene
TL;DR: 3-Methyl-1,5-cyclooctadiene (CAS 56568-11-7) is a chemical compound with molecular formula C9H14 and molecular weight 122.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylcycloocta-1,5-diene
Also Known As: 3-Methyl-1,5-cyclooctadiene, 3-methylcycloocta-1,5-diene, 4-[2-(2-Methoxyethoxy)ethoxy]phenylamine, 5,6-dihydrobenzo[h]quinoline,2,4,6-trinitrophenol, 634-679-5
| Molecular Formula | C9H14 |
|---|---|
| Molecular Weight | 122.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 122.10955 |
| Heavy Atoms | 9 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 56568-11-7 |
|---|---|
| SMILES | CC1CC=CCCC=C1 |
| InChIKey | WEPNHFXHEPXGAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methyl-1,5-cyclooctadiene (CAS 56568-11-7), with molecular formula C9H14 and molecular weight 122.11 g/mol. IUPAC: 3-methylcycloocta-1,5-diene.
Chemical Property Profile of 3-Methyl-1,5-cyclooctadiene
Property Insights of 3-Methyl-1,5-cyclooctadiene
The XLogP value of 3.1 indicates that 3-Methyl-1,5-cyclooctadiene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Methyl-1,5-cyclooctadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-1,5-cyclooctadiene 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-Methyl-1,5-cyclooctadiene?
The CAS number of 3-Methyl-1,5-cyclooctadiene is 56568-11-7.
What is the molecular formula of 3-Methyl-1,5-cyclooctadiene?
The molecular formula of 3-Methyl-1,5-cyclooctadiene is C9H14.
What is the molecular weight of 3-Methyl-1,5-cyclooctadiene?
The molecular weight of 3-Methyl-1,5-cyclooctadiene is 122.11 g/mol.
Where can I buy 3-Methyl-1,5-cyclooctadiene?
You can request a quote for 3-Methyl-1,5-cyclooctadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-1,5-cyclooctadiene?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1,5-cyclooctadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.