Di-cyclohexadiene
TL;DR: Di-cyclohexadiene (CAS 703-35-5) is a chemical compound with molecular formula C12H16 and molecular weight 160.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tricyclo[6.2.2.02,7]dodeca-3,9-diene
Also Known As: Di-cyclohexadiene, 2,5-ethanobicyclo[4.4.0]-3,7-decadiene, Tricyclo[6.2.2.02,7]dodeca-3,9-diene, endo-tricyclo[6.2.2.02,7]dodecadiene-3,9, 1,4,4a,5,6,8a-Hexahydro-1,4-ethanonaphthalene
| Molecular Formula | C12H16 |
|---|---|
| Molecular Weight | 160.13 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.1252 |
| Heavy Atoms | 12 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 703-35-5 |
|---|---|
| SMILES | C1CC2C3CCC(C2C=C1)C=C3 |
| InChIKey | OPOFYMSEXICFOW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Di-cyclohexadiene (CAS 703-35-5), with molecular formula C12H16 and molecular weight 160.13 g/mol. IUPAC: tricyclo[6.2.2.02,7]dodeca-3,9-diene.
Chemical Property Profile of Di-cyclohexadiene
Property Insights of Di-cyclohexadiene
The XLogP value of 3.6 indicates that Di-cyclohexadiene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Di-cyclohexadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Di-cyclohexadiene 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 Di-cyclohexadiene?
The CAS number of Di-cyclohexadiene is 703-35-5.
What is the molecular formula of Di-cyclohexadiene?
The molecular formula of Di-cyclohexadiene is C12H16.
What is the molecular weight of Di-cyclohexadiene?
The molecular weight of Di-cyclohexadiene is 160.13 g/mol.
Where can I buy Di-cyclohexadiene?
You can request a quote for Di-cyclohexadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di-cyclohexadiene?
Yes, KEHONG BIO provides custom synthesis services for Di-cyclohexadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.