TL;DR: 4-(4-Hydroxyphenyl)benzaldehyde (CAS 100980-82-3) is a chemical compound with molecular formula C13H10O2 and molecular weight 198.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-hydroxyphenyl)benzaldehyde
Also Known As: 4-(4-hydroxyphenyl)benzaldehyde, 4-(4-Formylphenyl)phenol, 4'-hydroxy-[1,1'-biphenyl]-4-carbaldehyde, p-oxyphenylbenzaldehyde, 4'-Hydroxy-biphenyl-4-carbaldehyde
| Molecular Formula | C13H10O2 |
| Molecular Weight | 198.06808 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.06808 Da |
| Heavy Atoms | 15 |
| Complexity | 199.0 |
| SMILES | C1=CC(=CC=C1C=O)C2=CC=C(C=C2)O |
| InChIKey | LUWJPGMZEAYDBA-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Hydroxyphenyl)benzaldehyde. With a topological polar surface area (TPSA) of 37.3 Ų, 4-(4-Hydroxyphenyl)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Hydroxyphenyl)benzaldehyde 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-(4-Hydroxyphenyl)benzaldehyde is 100980-82-3.
The molecular formula of 4-(4-Hydroxyphenyl)benzaldehyde is C13H10O2.
The molecular weight of 4-(4-Hydroxyphenyl)benzaldehyde is 198.06808 g/mol.
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