TL;DR: 4-Hydroxybenzophenone oxime (CAS 81123-44-6) is a chemical compound with molecular formula C13H11NO2 and molecular weight 213.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(N-hydroxy-C-phenylcarbonimidoyl)phenol
Also Known As: 4-hydroxybenzophenone oxime, Methanone, (4-hydroxyphenyl)phenyl-, oxime, 4-[(hydroxyamino)-phenylmethylidene]cyclohexa-2,5-dien-1-one
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H11NO2 |
| Molecular Weight | 213.07898 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 52.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.07898 Da |
| Heavy Atoms | 16 |
| Complexity | 238.0 |
| SMILES | C1=CC=C(C=C1)C(=NO)C2=CC=C(C=C2)O |
| InChIKey | BINATKJGYKUBBZ-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxybenzophenone oxime. With a topological polar surface area (TPSA) of 52.8 Ų, 4-Hydroxybenzophenone oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxybenzophenone oxime has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Hydroxybenzophenone oxime is 81123-44-6.
The molecular formula of 4-Hydroxybenzophenone oxime is C13H11NO2.
The molecular weight of 4-Hydroxybenzophenone oxime is 213.07898 g/mol.
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