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Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine
TL;DR: Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine (CAS 2164-42-3) is a chemical compound with molecular formula C16H17NO2 and molecular weight 255.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-1-(2,3-dihydro-1,4-benzodioxin-3-yl)methanamine
Also Known As: Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine, N-Benzyl-1-(2,3-dihydrobenzo[b][1,4]dioxin-2-yl)methanamine, N-benzyl-1-(2,3-dihydro-1,4-benzodioxin-3-yl)methanamine, BAS 07326620, benzyl(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)amine
| Molecular Formula | C16H17NO2 |
|---|---|
| Molecular Weight | 255.13 g/mol |
| LogP | 2.6162 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.12593 |
| Heavy Atoms | 19 |
| Complexity | 527.282 |
Chemical Identifiers
| CAS Number | 2164-42-3 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2O1)CNCC3=CC=CC=C3 |
Product Overview
Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine (CAS 2164-42-3), with molecular formula C16H17NO2 and molecular weight 255.13 g/mol. IUPAC: N-benzyl-1-(2,3-dihydro-1,4-benzodioxin-3-yl)methanamine.
Chemical Property Profile of Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine
Property Insights of Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine
The XLogP value of 2.6162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine. With a topological polar surface area (TPSA) of 30.49 Ų, Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine 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 Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine?
The CAS number of Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine is 2164-42-3.
What is the molecular formula of Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine?
The molecular formula of Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine is C16H17NO2.
What is the molecular weight of Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine?
The molecular weight of Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine is 255.13 g/mol.
Where can I buy Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine?
You can request a quote for Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine?
Yes, KEHONG BIO provides custom synthesis services for Benzyl-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.