TL;DR: 3,4-Chrysenedione (CAS 103088-83-1) is a chemical compound with molecular formula C18H10O2 and molecular weight 258.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
chrysene-3,4-dione
Also Known As: 3,4-CHRYSENEDIONE, Chrysene-3,4-quinone, chrysene-3,4-dione, Hydrophobic protein, transmissible gastroenteritis virus, CCRIS 2024
| Molecular Formula | C18H10O2 |
| Molecular Weight | 258.06808 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 258.06808 Da |
| Heavy Atoms | 20 |
| Complexity | 464.0 |
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C(=O)C(=O)C=C4 |
| InChIKey | LLOUAGKAVSGKKD-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 3,4-Chrysenedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 3,4-Chrysenedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Chrysenedione has 0 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 3,4-Chrysenedione is 103088-83-1.
The molecular formula of 3,4-Chrysenedione is C18H10O2.
The molecular weight of 3,4-Chrysenedione is 258.06808 g/mol.
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