Oxecane-2,10-dione
TL;DR: Oxecane-2,10-dione (CAS 4196-95-6) is a chemical compound with molecular formula C9H14O3 and molecular weight 170.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxecane-2,10-dione
Also Known As: Oxecane-2,10-dione, 2,10-Oxecanedione, azelaic anhydride, AZELAICANHYDRIDE, azelayl anhydride
| Molecular Formula | C9H14O3 |
|---|---|
| Molecular Weight | 170.09 g/mol |
| LogP | 1.8005 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.0943 |
| Heavy Atoms | 12 |
| Complexity | 156.61246 |
Chemical Identifiers
| CAS Number | 4196-95-6 |
|---|---|
| SMILES | C1CCCC(=O)OC(=O)CCC1 |
Product Overview
Oxecane-2,10-dione (CAS 4196-95-6), with molecular formula C9H14O3 and molecular weight 170.09 g/mol. IUPAC: oxecane-2,10-dione.
Chemical Property Profile of Oxecane-2,10-dione
Property Insights of Oxecane-2,10-dione
The XLogP value of 1.8005 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxecane-2,10-dione. With a topological polar surface area (TPSA) of 43.37 Ų, Oxecane-2,10-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxecane-2,10-dione has 0 hydrogen bond donor(s) and 3 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 Oxecane-2,10-dione?
The CAS number of Oxecane-2,10-dione is 4196-95-6.
What is the molecular formula of Oxecane-2,10-dione?
The molecular formula of Oxecane-2,10-dione is C9H14O3.
What is the molecular weight of Oxecane-2,10-dione?
The molecular weight of Oxecane-2,10-dione is 170.09 g/mol.
Where can I buy Oxecane-2,10-dione?
You can request a quote for Oxecane-2,10-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxecane-2,10-dione?
Yes, KEHONG BIO provides custom synthesis services for Oxecane-2,10-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.