TL;DR: 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-ol (CAS 120466-72-0) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanol
Also Known As: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethan-1-ol, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanol, 1-(2,3-DIHYDROBENZO[B][1,4]DIOXIN-6-YL)ETHAN-1-OL, 1-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)ethanol, (1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethan-1-ol
| Molecular Formula | C10H12O3 |
| Molecular Weight | 180.07864 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.07864 Da |
| Heavy Atoms | 13 |
| Complexity | 172.0 |
| SMILES | CC(C1=CC2=C(C=C1)OCCO2)O |
| InChIKey | QSYTYSANYGEBEZ-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-ol. With a topological polar surface area (TPSA) of 38.7 Ų, 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-ol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-ol is 120466-72-0.
The molecular formula of 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-ol is C10H12O3.
The molecular weight of 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-ol is 180.07864 g/mol.
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