TL;DR: Benz(e)acephenanthrylene, 6-fluoro- (CAS 125811-13-4) is a chemical compound with molecular formula C20H11F and molecular weight 270.08447 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
18-fluoropentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaene
Also Known As: 6-Fluorobenz(e)acephenanthrylene, Benzo[b]fluoranthene,6-fluoro-, Benz(e)acephenanthrylene, 6-fluoro-, 6-fluorobenzo[b]fluoranthene, 6-Fluorobenz[e]acephenanthrylene
| Molecular Formula | C20H11F |
| Molecular Weight | 270.08447 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 270.08447 Da |
| Heavy Atoms | 21 |
| Complexity | 405.0 |
| SMILES | C1=CC=C2C3=C4C(=CC=C3)C5=C(C4=CC2=C1)C=C(C=C5)F |
| InChIKey | BEOGFRKXFIALQV-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that Benz(e)acephenanthrylene, 6-fluoro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benz(e)acephenanthrylene, 6-fluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benz(e)acephenanthrylene, 6-fluoro- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Benz(e)acephenanthrylene, 6-fluoro- is 125811-13-4.
The molecular formula of Benz(e)acephenanthrylene, 6-fluoro- is C20H11F.
The molecular weight of Benz(e)acephenanthrylene, 6-fluoro- is 270.08447 g/mol.
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