1,11-Dodecadiene
TL;DR: 1,11-Dodecadiene (CAS 5876-87-9) 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.
dodeca-1,11-diene
Also Known As: 1,11-DODECADIENE, dodeca-1,11-diene, Dodecadiene, 1,11-, 1,6-Bis(2-propenyl)hexane, 98% +(stabilized with TBC)
| Molecular Formula | C12H22 |
|---|---|
| Molecular Weight | 166.17 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 9 |
| Exact Mass | 166.17215 |
| Heavy Atoms | 12 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 5876-87-9 |
|---|---|
| SMILES | C=CCCCCCCCCC=C |
| InChIKey | IYPLTVKTLDQUGG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,11-Dodecadiene (CAS 5876-87-9), with molecular formula C12H22 and molecular weight 166.17 g/mol. IUPAC: dodeca-1,11-diene.
Chemical Property Profile of 1,11-Dodecadiene
Property Insights of 1,11-Dodecadiene
The XLogP value of 6.3 indicates that 1,11-Dodecadiene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,11-Dodecadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,11-Dodecadiene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,11-Dodecadiene?
The CAS number of 1,11-Dodecadiene is 5876-87-9.
What is the molecular formula of 1,11-Dodecadiene?
The molecular formula of 1,11-Dodecadiene is C12H22.
What is the molecular weight of 1,11-Dodecadiene?
The molecular weight of 1,11-Dodecadiene is 166.17 g/mol.
Where can I buy 1,11-Dodecadiene?
You can request a quote for 1,11-Dodecadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,11-Dodecadiene?
Yes, KEHONG BIO provides custom synthesis services for 1,11-Dodecadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.