3,6-Dichlorocyclohexane-1,2-dione
TL;DR: 3,6-Dichlorocyclohexane-1,2-dione (CAS 71463-51-9) is a chemical compound with molecular formula C6H6Cl2O2 and molecular weight 179.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-dichlorocyclohexane-1,2-dione
Also Known As: 3,6-Dichlorocyclohexane-1,2-dione, EINECS 275-489-9, 3,6-Dichloro-1,2-cyclohexanedione, 1,2-Cyclohexanedione,3,6-dichloro-, 3,6-dichloro-cyclohexane-1,2-dione
| Molecular Formula | C6H6Cl2O2 |
|---|---|
| Molecular Weight | 179.97 g/mol |
| LogP | 1.1332 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 179.97449 |
| Heavy Atoms | 10 |
| Complexity | 158.58662 |
Chemical Identifiers
| CAS Number | 71463-51-9 |
|---|---|
| SMILES | C1CC(C(=O)C(=O)C1Cl)Cl |
Product Overview
3,6-Dichlorocyclohexane-1,2-dione (CAS 71463-51-9), with molecular formula C6H6Cl2O2 and molecular weight 179.97 g/mol. IUPAC: 3,6-dichlorocyclohexane-1,2-dione.
Chemical Property Profile of 3,6-Dichlorocyclohexane-1,2-dione
Property Insights of 3,6-Dichlorocyclohexane-1,2-dione
The XLogP value of 1.1332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Dichlorocyclohexane-1,2-dione. With a topological polar surface area (TPSA) of 34.14 Ų, 3,6-Dichlorocyclohexane-1,2-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Dichlorocyclohexane-1,2-dione 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 3,6-Dichlorocyclohexane-1,2-dione?
The CAS number of 3,6-Dichlorocyclohexane-1,2-dione is 71463-51-9.
What is the molecular formula of 3,6-Dichlorocyclohexane-1,2-dione?
The molecular formula of 3,6-Dichlorocyclohexane-1,2-dione is C6H6Cl2O2.
What is the molecular weight of 3,6-Dichlorocyclohexane-1,2-dione?
The molecular weight of 3,6-Dichlorocyclohexane-1,2-dione is 179.97 g/mol.
Where can I buy 3,6-Dichlorocyclohexane-1,2-dione?
You can request a quote for 3,6-Dichlorocyclohexane-1,2-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Dichlorocyclohexane-1,2-dione?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Dichlorocyclohexane-1,2-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.