TL;DR: 6H-Dibenzo(b,d)pyran-6-one, 3,4,7,8-tetrahydroxy- (CAS 131086-95-8) is a chemical compound with molecular formula C13H8O6 and molecular weight 260.03207 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4,7,8-tetrahydroxybenzo[c]chromen-6-one
Also Known As: 6H-Dibenzo(b,d)pyran-6-one, 3,4,7,8-tetrahydroxy-, 6H-Dibenzo(b,d)pyran-6-one, 7,8-dimethoxy-, 3,4,7,8-tetrahydroxybenzo[c]chromen-6-one, 3,4,7,8-tetrahydroxy-6h-dibenzo[b,d]pyran-6-one, 6H-Dibenzo[b,d]pyran-6-one, 3,4,7,8-tetrahydroxy-
| Molecular Formula | C13H8O6 |
| Molecular Weight | 260.03207 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 260.03207 Da |
| Heavy Atoms | 19 |
| Complexity | 372.0 |
| SMILES | C1=CC(=C(C2=C1C3=C(C(=C(C=C3)O)O)OC2=O)O)O |
| InChIKey | JJVYUTLKWCEZBG-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6H-Dibenzo(b,d)pyran-6-one, 3,4,7,8-tetrahydroxy-. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6H-Dibenzo(b,d)pyran-6-one, 3,4,7,8-tetrahydroxy-. Following Lipinski's Rule of Five, 6H-Dibenzo(b,d)pyran-6-one, 3,4,7,8-tetrahydroxy- has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6H-Dibenzo(b,d)pyran-6-one, 3,4,7,8-tetrahydroxy- is 131086-95-8.
The molecular formula of 6H-Dibenzo(b,d)pyran-6-one, 3,4,7,8-tetrahydroxy- is C13H8O6.
The molecular weight of 6H-Dibenzo(b,d)pyran-6-one, 3,4,7,8-tetrahydroxy- is 260.03207 g/mol.
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