2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione
TL;DR: 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione (CAS 87772-81-4) is a chemical compound with molecular formula C14H15ClN2O2 and molecular weight 278.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)diazenyl]-5,5-dimethylcyclohexane-1,3-dione
Also Known As: 2-[(4-chlorophenyl)diazenyl]-5,5-dimethylcyclohexane-1,3-dione, 1,3-Cyclohexanedione, 2-[(4-chlorophenyl)azo]-5,5-dimethyl-, 2-((4-CHLOROPHENYL)DIAZENYL)-5,5-DIMETHYLCYCLOHEXANE-1,3-DIONE, 2-(4-chlorophenyl)diazenyl-5,5-dimethyl-cyclohexane-1,3-dione
| Molecular Formula | C14H15ClN2O2 |
|---|---|
| Molecular Weight | 278.08 g/mol |
| LogP | 3.7505 |
| Topological Polar Surface Area | 58.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.0822 |
| Heavy Atoms | 19 |
| Complexity | 514.8819 |
Chemical Identifiers
| CAS Number | 87772-81-4 |
|---|---|
| SMILES | CC1(CC(=O)C(C(=O)C1)N=NC2=CC=C(C=C2)Cl)C |
Product Overview
2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione (CAS 87772-81-4), with molecular formula C14H15ClN2O2 and molecular weight 278.08 g/mol. IUPAC: 2-[(4-chlorophenyl)diazenyl]-5,5-dimethylcyclohexane-1,3-dione.
Chemical Property Profile of 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione
Property Insights of 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione
The XLogP value of 3.7505 indicates that 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.86 Ų, 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione has 0 hydrogen bond donor(s) and 4 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-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione?
The CAS number of 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione is 87772-81-4.
What is the molecular formula of 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione?
The molecular formula of 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione is C14H15ClN2O2.
What is the molecular weight of 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione?
The molecular weight of 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione is 278.08 g/mol.
Where can I buy 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione?
You can request a quote for 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-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 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-Chlorophenyl)diazenyl)-5,5-dimethylcyclohexane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.