TL;DR: Ethyl tribenzocentrotriquinacene (CAS 140389-04-4) is a chemical compound with molecular formula C24H20 and molecular weight 308.1565 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
22-ethylhexacyclo[13.6.1.02,7.08,22.09,14.016,21]docosa-2,4,6,9,11,13,16,18,20-nonaene
Also Known As: Ethyl tribenzocentrotriquinacene, 12d-Ethyl-4b,8b,12b,12d-tetrahydrodibenzo[2,3:4,5]pentaleno[1,6-ab]indene, 12d-Ethyl-4b,8b,12b,12d-tetrahydrodibenzo[2,3:4,5]pentaleno[1,6-ab]indene #
| Molecular Formula | C24H20 |
| Molecular Weight | 308.1565 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 308.1565 Da |
| Heavy Atoms | 24 |
| Complexity | 401.0 |
| SMILES | CCC12C3C4=CC=CC=C4C1C5=CC=CC=C5C2C6=CC=CC=C36 |
| InChIKey | BOZYJODSEBMVCN-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that Ethyl tribenzocentrotriquinacene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Ethyl tribenzocentrotriquinacene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl tribenzocentrotriquinacene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Ethyl tribenzocentrotriquinacene is 140389-04-4.
The molecular formula of Ethyl tribenzocentrotriquinacene is C24H20.
The molecular weight of Ethyl tribenzocentrotriquinacene is 308.1565 g/mol.
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