2,11-Dodecanedione
TL;DR: 2,11-Dodecanedione (CAS 7029-09-6) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dodecane-2,11-dione
Also Known As: dodecane-2,11-dione, 2,11-Dodecanedione, 2,11-Dodecadione, RefChem:241904
| Molecular Formula | C12H22O2 |
|---|---|
| Molecular Weight | 198.16 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 198.16199 |
| Heavy Atoms | 14 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 7029-09-6 |
|---|---|
| SMILES | CC(=O)CCCCCCCCC(=O)C |
| InChIKey | IALFUWZSWAKBDF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,11-Dodecanedione (CAS 7029-09-6), with molecular formula C12H22O2 and molecular weight 198.16 g/mol. IUPAC: dodecane-2,11-dione.
Chemical Property Profile of 2,11-Dodecanedione
Property Insights of 2,11-Dodecanedione
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,11-Dodecanedione. With a topological polar surface area (TPSA) of 34.1 Ų, 2,11-Dodecanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,11-Dodecanedione has 0 hydrogen bond donor(s) and 2 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 2,11-Dodecanedione?
The CAS number of 2,11-Dodecanedione is 7029-09-6.
What is the molecular formula of 2,11-Dodecanedione?
The molecular formula of 2,11-Dodecanedione is C12H22O2.
What is the molecular weight of 2,11-Dodecanedione?
The molecular weight of 2,11-Dodecanedione is 198.16 g/mol.
Where can I buy 2,11-Dodecanedione?
You can request a quote for 2,11-Dodecanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,11-Dodecanedione?
Yes, KEHONG BIO provides custom synthesis services for 2,11-Dodecanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.