TL;DR: Picene, 1,2,3,4-tetrahydro-2,2,9-trimethyl- (CAS 1242-76-8) is a chemical compound with molecular formula C25H24 and molecular weight 324.1878 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,9-trimethyl-3,4-dihydro-1H-picene
Also Known As: 2,2,9-trimethyl-3,4-dihydro-1H-picene, Picene, 1,2,3,4-tetrahydro-2,2,9-trimethyl-, 1,2,3,4-Tetrahydro-2,2,9-trimethylpicene, C25-H24, 2,2,9-TRIMETHYL-1,2,3,4-TETRAHYDROPICENE
| Molecular Formula | C25H24 |
| Molecular Weight | 324.1878 g/mol |
| XLogP | 8.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 324.1878 Da |
| Heavy Atoms | 25 |
| Complexity | 490.0 |
| SMILES | CC1=C2C=CC3=C(C2=CC=C1)C=CC4=C3C=CC5=C4CC(CC5)(C)C |
| InChIKey | QTTSLFHFYFQOPR-UHFFFAOYSA-N |
The XLogP value of 8.1 indicates that Picene, 1,2,3,4-tetrahydro-2,2,9-trimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Picene, 1,2,3,4-tetrahydro-2,2,9-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Picene, 1,2,3,4-tetrahydro-2,2,9-trimethyl- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Picene, 1,2,3,4-tetrahydro-2,2,9-trimethyl- is 1242-76-8.
The molecular formula of Picene, 1,2,3,4-tetrahydro-2,2,9-trimethyl- is C25H24.
The molecular weight of Picene, 1,2,3,4-tetrahydro-2,2,9-trimethyl- is 324.1878 g/mol.
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