![5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione structure](/static/products/7256/72567-18-1.webp)
5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione
TL;DR: 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione (CAS 72567-18-1) is a chemical compound with molecular formula C15H22O3 and molecular weight 250.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione
Also Known As: 5,5-dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione, 5,5-Dimethyl-2-(2-oxo-cyclohexylmethyl)-cyclohexane-1,3-dione, 1,3-Cyclohexanedione, 5,5-dimethyl-2-[(2-oxocyclohexyl)methyl]-
| Molecular Formula | C15H22O3 |
|---|---|
| Molecular Weight | 250.16 g/mol |
| LogP | 2.7102 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.15689 |
| Heavy Atoms | 18 |
| Complexity | 361.19995 |
Chemical Identifiers
| CAS Number | 72567-18-1 |
|---|---|
| SMILES | CC1(CC(=O)C(C(=O)C1)CC2CCCCC2=O)C |
Product Overview
5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione (CAS 72567-18-1), with molecular formula C15H22O3 and molecular weight 250.16 g/mol. IUPAC: 5,5-dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione.
Chemical Property Profile of 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione
Property Insights of 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione
The XLogP value of 2.7102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione. With a topological polar surface area (TPSA) of 51.21 Ų, 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-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 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione?
The CAS number of 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione is 72567-18-1.
What is the molecular formula of 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione?
The molecular formula of 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione is C15H22O3.
What is the molecular weight of 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione?
The molecular weight of 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione is 250.16 g/mol.
Where can I buy 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione?
You can request a quote for 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Dimethyl-2-[(2-oxocyclohexyl)methyl]cyclohexane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.