TL;DR: 8-(2,3-Dimethoxyphenyl)-7,8-dihydro-6-methoxy-6,7-dimethyl-6H-1,3-dioxolo(4,5-g)(1)benzopyran (CAS 117211-94-6) is a chemical compound with molecular formula C21H24O6 and molecular weight 372.1573 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-(2,3-dimethoxyphenyl)-6-methoxy-6,7-dimethyl-7,8-dihydro-[1,3]dioxolo[4,5-g]chromene
Also Known As: 8-(2,3-Dimethoxyphenyl)-7,8-dihydro-6-methoxy-6,7-dimethyl-6H-1,3-dioxolo(4,5-g)(1)benzopyran, 6H-1,3-Dioxolo(4,5-g)(1)benzopyran, 8-(2,3-dimethoxyphenyl)-7,8-dihydro-6-methoxy-6,7-dimethyl-, 8-(2,3-dimethoxyphenyl)-6-methoxy-6,7-dimethyl-7,8-dihydro-[1,3]dioxolo[4,5-g]chromene, 8-(2,3-Dimethoxyphenyl)-6-methoxy-6,7-dimethyl-7,8-dihydro-2H,6H-[1,3]dioxolo[4,5-g][1]benzopyran
| Molecular Formula | C21H24O6 |
| Molecular Weight | 372.1573 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.1573 Da |
| Heavy Atoms | 27 |
| Complexity | 515.0 |
| SMILES | CC1C(C2=CC3=C(C=C2OC1(C)OC)OCO3)C4=C(C(=CC=C4)OC)OC |
| InChIKey | KIXHRNZFVWKEKY-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that 8-(2,3-Dimethoxyphenyl)-7,8-dihydro-6-methoxy-6,7-dimethyl-6H-1,3-dioxolo(4,5-g)(1)benzopyran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 8-(2,3-Dimethoxyphenyl)-7,8-dihydro-6-methoxy-6,7-dimethyl-6H-1,3-dioxolo(4,5-g)(1)benzopyran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-(2,3-Dimethoxyphenyl)-7,8-dihydro-6-methoxy-6,7-dimethyl-6H-1,3-dioxolo(4,5-g)(1)benzopyran has 0 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 8-(2,3-Dimethoxyphenyl)-7,8-dihydro-6-methoxy-6,7-dimethyl-6H-1,3-dioxolo(4,5-g)(1)benzopyran is 117211-94-6.
The molecular formula of 8-(2,3-Dimethoxyphenyl)-7,8-dihydro-6-methoxy-6,7-dimethyl-6H-1,3-dioxolo(4,5-g)(1)benzopyran is C21H24O6.
The molecular weight of 8-(2,3-Dimethoxyphenyl)-7,8-dihydro-6-methoxy-6,7-dimethyl-6H-1,3-dioxolo(4,5-g)(1)benzopyran is 372.1573 g/mol.
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