1,4-Benzodioxan, 2-(1-aminoethyl)-
TL;DR: 1,4-Benzodioxan, 2-(1-aminoethyl)- (CAS 2469-18-3) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanamine
Also Known As: 2-(1-Aminoethyl)-1,4-benzodioxane, 1-(1,4-benzodioxan-2-yl)ethylamine, 1,4-BENZODIOXAN, 2-(1-AMINOETHYL)-, 1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanamine, 1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethan-1-amine
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 2469-18-3 |
|---|---|
| SMILES | CC(C1COC2=CC=CC=C2O1)N |
| InChIKey | AANTWDPFFAREMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Benzodioxan, 2-(1-aminoethyl)- (CAS 2469-18-3), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: 1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanamine.
Chemical Property Profile of 1,4-Benzodioxan, 2-(1-aminoethyl)-
Property Insights of 1,4-Benzodioxan, 2-(1-aminoethyl)-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Benzodioxan, 2-(1-aminoethyl)-. With a topological polar surface area (TPSA) of 44.5 Ų, 1,4-Benzodioxan, 2-(1-aminoethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzodioxan, 2-(1-aminoethyl)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-Benzodioxan, 2-(1-aminoethyl)-?
The CAS number of 1,4-Benzodioxan, 2-(1-aminoethyl)- is 2469-18-3.
What is the molecular formula of 1,4-Benzodioxan, 2-(1-aminoethyl)-?
The molecular formula of 1,4-Benzodioxan, 2-(1-aminoethyl)- is C10H13NO2.
What is the molecular weight of 1,4-Benzodioxan, 2-(1-aminoethyl)-?
The molecular weight of 1,4-Benzodioxan, 2-(1-aminoethyl)- is 179.09 g/mol.
Where can I buy 1,4-Benzodioxan, 2-(1-aminoethyl)-?
You can request a quote for 1,4-Benzodioxan, 2-(1-aminoethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Benzodioxan, 2-(1-aminoethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Benzodioxan, 2-(1-aminoethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.