2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one
TL;DR: 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one (CAS 1023496-35-6) is a chemical compound with molecular formula C12H11ClFNO and molecular weight 239.05132 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-3-(2-fluoroanilino)cyclohex-2-en-1-one
Also Known As: 2-chloro-3-(2-fluoroanilino)cyclohex-2-en-1-one, 2-CHLORO-3-((2-FLUOROPHENYL)AMINO)CYCLOHEX-2-EN-1-ONE, 2-chloro-3-[(2-fluorophenyl)amino]cyclohex-2-en-1-one
Technical Specifications
| Molecular Formula | C12H11ClFNO |
| Molecular Weight | 239.05132 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.05132 Da |
| Heavy Atoms | 16 |
| Complexity | 316.0 |
| SMILES | C1CC(=C(C(=O)C1)Cl)NC2=CC=CC=C2F |
| InChIKey | DBWPKMRSBUROSD-UHFFFAOYSA-N |
Chemical Property Profile of 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one
Property Insights of 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one
The XLogP value of 3.1 indicates that 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one?
The CAS number of 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one is 1023496-35-6.
What is the molecular formula of 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one?
The molecular formula of 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one is C12H11ClFNO.
What is the molecular weight of 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one?
The molecular weight of 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one is 239.05132 g/mol.
Where can I buy 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one?
You can request a quote for 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one?
Yes, CoreyChem provides custom synthesis services for 2-Chloro-3-((2-fluorophenyl)amino)cyclohex-2-EN-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.