2-(4-Aminophenyl)cyclohexan-1-one
TL;DR: 2-(4-Aminophenyl)cyclohexan-1-one (CAS 100389-81-9) is a chemical compound with molecular formula C12H15NO and molecular weight 189.11537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-aminophenyl)cyclohexan-1-one
Also Known As: 2-(4-aminophenyl)cyclohexan-1-one, 2-(4-Aminophenyl)cyclohexanone, J1.921.215G
Technical Specifications
| Molecular Formula | C12H15NO |
| Molecular Weight | 189.11537 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.11537 Da |
| Heavy Atoms | 14 |
| Complexity | 206.0 |
| SMILES | C1CCC(=O)C(C1)C2=CC=C(C=C2)N |
| InChIKey | DWEPLSLTBKKJTR-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Aminophenyl)cyclohexan-1-one
Property Insights of 2-(4-Aminophenyl)cyclohexan-1-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Aminophenyl)cyclohexan-1-one. With a topological polar surface area (TPSA) of 43.1 Ų, 2-(4-Aminophenyl)cyclohexan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Aminophenyl)cyclohexan-1-one has 1 hydrogen bond donor(s) and 2 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-(4-Aminophenyl)cyclohexan-1-one?
The CAS number of 2-(4-Aminophenyl)cyclohexan-1-one is 100389-81-9.
What is the molecular formula of 2-(4-Aminophenyl)cyclohexan-1-one?
The molecular formula of 2-(4-Aminophenyl)cyclohexan-1-one is C12H15NO.
What is the molecular weight of 2-(4-Aminophenyl)cyclohexan-1-one?
The molecular weight of 2-(4-Aminophenyl)cyclohexan-1-one is 189.11537 g/mol.
Where can I buy 2-(4-Aminophenyl)cyclohexan-1-one?
You can request a quote for 2-(4-Aminophenyl)cyclohexan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Aminophenyl)cyclohexan-1-one?
Yes, CoreyChem provides custom synthesis services for 2-(4-Aminophenyl)cyclohexan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.