3-(beta-Aminoethyl)-5-methoxybenzofuran
TL;DR: 3-(beta-Aminoethyl)-5-methoxybenzofuran (CAS 27892-38-2) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-methoxy-1-benzofuran-3-yl)ethanamine
Also Known As: 2-(5-methoxybenzofuran-2-yl)ethanamine, 2-(5-methoxybenzofuran-3-yl)ethanamine, 3-(beta-aminoethyl)-5-methoxybenzofuran, 2-(5-methoxy-benzofuran-3-yl)-ethylamine, 2-(5-methoxy-1-benzofuran-3-yl)ethanamine
| Molecular Formula | C11H13NO2 |
|---|---|
| Molecular Weight | 191.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 48.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.09464 |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 27892-38-2 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)OC=C2CCN |
| InChIKey | VGTWJKMPGQFFGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(beta-Aminoethyl)-5-methoxybenzofuran (CAS 27892-38-2), with molecular formula C11H13NO2 and molecular weight 191.09 g/mol. IUPAC: 2-(5-methoxy-1-benzofuran-3-yl)ethanamine.
Chemical Property Profile of 3-(beta-Aminoethyl)-5-methoxybenzofuran
Property Insights of 3-(beta-Aminoethyl)-5-methoxybenzofuran
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(beta-Aminoethyl)-5-methoxybenzofuran. With a topological polar surface area (TPSA) of 48.4 Ų, 3-(beta-Aminoethyl)-5-methoxybenzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(beta-Aminoethyl)-5-methoxybenzofuran 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 3-(beta-Aminoethyl)-5-methoxybenzofuran?
The CAS number of 3-(beta-Aminoethyl)-5-methoxybenzofuran is 27892-38-2.
What is the molecular formula of 3-(beta-Aminoethyl)-5-methoxybenzofuran?
The molecular formula of 3-(beta-Aminoethyl)-5-methoxybenzofuran is C11H13NO2.
What is the molecular weight of 3-(beta-Aminoethyl)-5-methoxybenzofuran?
The molecular weight of 3-(beta-Aminoethyl)-5-methoxybenzofuran is 191.09 g/mol.
Where can I buy 3-(beta-Aminoethyl)-5-methoxybenzofuran?
You can request a quote for 3-(beta-Aminoethyl)-5-methoxybenzofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(beta-Aminoethyl)-5-methoxybenzofuran?
Yes, KEHONG BIO provides custom synthesis services for 3-(beta-Aminoethyl)-5-methoxybenzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.