TL;DR: 4-Aminoheptanoylphenone (CAS 53033-83-3) is a chemical compound with molecular formula C13H19NO and molecular weight 205.14667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-aminophenyl)heptan-1-one
Also Known As: p-Amino enanthophenone, 4-Aminoheptanoylphenone, Heptanophenone, p-amino-, p-Aminoheptanophenone, Enanthophenone, p-amino-
| Molecular Formula | C13H19NO |
| Molecular Weight | 205.14667 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 205.14667 Da |
| Heavy Atoms | 15 |
| Complexity | 183.0 |
| SMILES | CCCCCCC(=O)C1=CC=C(C=C1)N |
| InChIKey | RPQVIDVZOLKLQP-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 4-Aminoheptanoylphenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 4-Aminoheptanoylphenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Aminoheptanoylphenone has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Aminoheptanoylphenone is 53033-83-3.
The molecular formula of 4-Aminoheptanoylphenone is C13H19NO.
The molecular weight of 4-Aminoheptanoylphenone is 205.14667 g/mol.
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