1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl-
TL;DR: 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl- (CAS 7298-86-4) is a chemical compound with molecular formula C8H10Cl2O2 and molecular weight 208.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dichloro-5,5-dimethylcyclohexane-1,3-dione
Also Known As: dichlorodimedone, 2,2-Dichlormethon, 2,2-Dichloro-5,5-dimethyl-1,3-cyclohexanedione, 2,2-dichloro-5,5-dimethylcyclohexane-1,3-dione, 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl-
| Molecular Formula | C8H10Cl2O2 |
|---|---|
| Molecular Weight | 208.01 g/mol |
| LogP | 2.1185 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.00578 |
| Heavy Atoms | 12 |
| Complexity | 221.44241 |
Chemical Identifiers
| CAS Number | 7298-86-4 |
|---|---|
| SMILES | CC1(CC(=O)C(C(=O)C1)(Cl)Cl)C |
Product Overview
1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl- (CAS 7298-86-4), with molecular formula C8H10Cl2O2 and molecular weight 208.01 g/mol. IUPAC: 2,2-dichloro-5,5-dimethylcyclohexane-1,3-dione.
Chemical Property Profile of 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl-
Property Insights of 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl-
The XLogP value of 2.1185 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl-. With a topological polar surface area (TPSA) of 34.14 Ų, 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl- 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 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl-?
The CAS number of 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl- is 7298-86-4.
What is the molecular formula of 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl-?
The molecular formula of 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl- is C8H10Cl2O2.
What is the molecular weight of 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl-?
The molecular weight of 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl- is 208.01 g/mol.
Where can I buy 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl-?
You can request a quote for 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Cyclohexanedione, 2,2-dichloro-5,5-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.