(2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium
TL;DR: (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium (CAS 81816-85-5) is a chemical compound with molecular formula C19H22NO2+ and molecular weight 296.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2H-chromen-2-yl-ethyl-methyl-phenylmethoxyazanium
Also Known As: 2H-chromen-2-yl-ethyl-methyl-phenylmethoxyazanium, N-Ethyl-3,4-dihydro-N-(4-methoxyphenyl)-2H-1-benzopyran-2-methanamine, (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium, (2H-1-Benzopyran-2-yl)(benzyloxy)(ethyl)(methyl)ammonium, 2H-1-BENZOPYRAN-2-METHANAMINE, N-ETHYL-3,4-DIHYDRO-N-(4-METHOXYPHENYL)-
| Molecular Formula | C19H22NO2+ |
|---|---|
| Molecular Weight | 296.17 g/mol |
| LogP | 4.0166 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.16504 |
| Heavy Atoms | 22 |
| Complexity | 653.49457 |
Chemical Identifiers
| CAS Number | 81816-85-5 |
|---|---|
| SMILES | CC[N+](C)(C1C=CC2=CC=CC=C2O1)OCC3=CC=CC=C3 |
Product Overview
(2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium (CAS 81816-85-5), with molecular formula C19H22NO2+ and molecular weight 296.17 g/mol. IUPAC: 2H-chromen-2-yl-ethyl-methyl-phenylmethoxyazanium.
Chemical Property Profile of (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium
Property Insights of (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium
The XLogP value of 4.0166 indicates that (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.46 Ų, (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium has 0 hydrogen bond donor(s) and 2 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 (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium?
The CAS number of (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium is 81816-85-5.
What is the molecular formula of (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium?
The molecular formula of (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium is C19H22NO2+.
What is the molecular weight of (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium?
The molecular weight of (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium is 296.17 g/mol.
Where can I buy (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium?
You can request a quote for (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium?
Yes, KEHONG BIO provides custom synthesis services for (2H-1-Benzopyran-2-yl)(benzyloxy)ethyl(methyl)ammonium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.