TL;DR: Delicial (CAS 113393-58-1) is a chemical compound with molecular formula C15H16O and molecular weight 212.12012 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-7-prop-1-en-2-yl-6,7-dihydroazulene-1-carbaldehyde
Also Known As: Delicial, 7-Isopropenyl-4-methyl-6,7-dihydro-1-azu, 4-methyl-7-prop-1-en-2-yl-6,7-dihydroazulene-1-carbaldehyde, 1-Azulenecarboxaldehyde, 6,7-dihydro-4-methyl-7-(1-methylethenyl)-, 4-METHYL-7-(PROP-1-EN-2-YL)-6,7-DIHYDROAZULENE-1-CARBALDEHYDE
| Molecular Formula | C15H16O |
| Molecular Weight | 212.12012 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.12012 Da |
| Heavy Atoms | 16 |
| Complexity | 470.0 |
| SMILES | CC1=CCC(C=C2C1=CC=C2C=O)C(=C)C |
| InChIKey | XFQHUKCOVBABSG-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Delicial. With a topological polar surface area (TPSA) of 17.1 Ų, Delicial exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Delicial has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Delicial is 113393-58-1.
The molecular formula of Delicial is C15H16O.
The molecular weight of Delicial is 212.12012 g/mol.
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