TL;DR: 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-amine (CAS 1047620-83-6) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09464 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)ethanamine
Also Known As: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamine, 1-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-ethylamine, BAS 03213259, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethan-1-amine, 1-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)ethan-1-amine
| Molecular Formula | C10H13NO2 |
| Molecular Weight | 179.09464 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.09464 Da |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
| SMILES | CC(C1=CC2=C(C=C1)OCCO2)N |
| InChIKey | ABUSRLBOAUOYSM-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-amine. With a topological polar surface area (TPSA) of 44.5 Ų, 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-amine 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-amine 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-amine is 1047620-83-6.
The molecular formula of 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-amine is C10H13NO2.
The molecular weight of 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-amine is 179.09464 g/mol.
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