Bencianol
(2R,3S)-2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-chromene-3,5,7-triol
| Molecular Formula | C28H22O6 |
|---|---|
| Molecular Weight | 454.5 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 88.4 A2 |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 454.14163 |
| Heavy Atoms | 34 |
| Complexity | 670.0 |
Chemical Identifiers
| CAS Number | 85443-48-7 |
|---|---|
| SMILES | C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC4=C(C=C3)OC(O4)(C5=CC=CC=C5)C6=CC=CC=C6)O |
| InChIKey | NGJOOUAZHCZCOW-WNCULLNHSA-N |
📖 Product Overview
Bencianol (CAS: 85443-48-7) is a chemical compound with molecular formula C28H22O6 and molecular weight 454.5 g/mol. Its IUPAC systematic name is (2R,3S)-2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-chromene-3,5,7-triol.
NGJOOUAZHCZCOW-WNCULLNHSA-N.
SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC4=C(C=C3)OC(O4)(C5=CC=CC=C5)C6=CC=CC=C6)O.
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