TL;DR: 6-Hydroxyhexa-2,4-dienal (CAS 141812-70-6) is a chemical compound with molecular formula C6H8O2 and molecular weight 112.05243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-hydroxyhexa-2,4-dienal
Also Known As: 6-Hydroxyhexa-2,4-dienal, 6-hydroxy-2,4-hexadienal, 6-Hydroxy-2,4-hexadienal (E,E)-, 6-Hydroxy-trans,trans-2,4-hexadienal, 2,4-Hexadienal,6-hydroxy-, (2E,4E)-
| Molecular Formula | C6H8O2 |
| Molecular Weight | 112.05243 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 112.05243 Da |
| Heavy Atoms | 8 |
| Complexity | 103.0 |
| SMILES | C(C=CC=CC=O)O |
| InChIKey | PCYZGEHNECVSCF-UHFFFAOYSA-N |
The XLogP value of -0.1 indicates that 6-Hydroxyhexa-2,4-dienal is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 37.3 Ų, 6-Hydroxyhexa-2,4-dienal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Hydroxyhexa-2,4-dienal 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 6-Hydroxyhexa-2,4-dienal is 141812-70-6.
The molecular formula of 6-Hydroxyhexa-2,4-dienal is C6H8O2.
The molecular weight of 6-Hydroxyhexa-2,4-dienal is 112.05243 g/mol.
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