![2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine structure](/static/products/3537/353779-56-3.webp)
2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine
TL;DR: 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine (CAS 353779-56-3) is a chemical compound with molecular formula C16H16FNO2 and molecular weight 273.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine
Also Known As: AB00089667-01, 2-(1,3-benzodioxol-5-yl)-N-(2-fluorobenzyl)ethanamine, 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine, 2-benzo[1,3]dioxol-5-yl-N-[(2-fluorophenyl)methyl]ethanamine, [2-(2H-1,3-benzodioxol-5-yl)ethyl][(2-fluorophenyl)methyl]amine
| Molecular Formula | C16H16FNO2 |
|---|---|
| Molecular Weight | 273.12 g/mol |
| LogP | 2.8867 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.11652 |
| Heavy Atoms | 20 |
| Complexity | 600.78076 |
Chemical Identifiers
| CAS Number | 353779-56-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CCNCC3=CC=CC=C3F |
Product Overview
2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine (CAS 353779-56-3), with molecular formula C16H16FNO2 and molecular weight 273.12 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine.
Chemical Property Profile of 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine
Property Insights of 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine
The XLogP value of 2.8867 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine. With a topological polar surface area (TPSA) of 30.49 Ų, 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine 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 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine?
The CAS number of 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine is 353779-56-3.
What is the molecular formula of 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine?
The molecular formula of 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine is C16H16FNO2.
What is the molecular weight of 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine?
The molecular weight of 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine is 273.12 g/mol.
Where can I buy 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine?
You can request a quote for 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-benzodioxol-5-yl)-N-[(2-fluorophenyl)methyl]ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.