3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate
TL;DR: 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate (CAS 1613-12-3) is a chemical compound with molecular formula C20H29NO6 and molecular weight 379.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-but-2-enedioic acid;N-ethyl-N-[[3-[(2-methylphenoxy)methyl]oxetan-3-yl]methyl]ethanamine
Also Known As: H.C. 6014, N,N-Diethyl-3-((o-tolyloxy)methyl)-3-oxetanemethylamine maleate, 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate, 3-Oxetanemethanamine, N,N-diethyl-3-((2-methylphenoxy)methyl)-, (Z)-2-butenedioate (1:1), (Z)-but-2-enedioic acid; N-ethyl-N-[[3-[(2-methylphenoxy)methyl]oxetan-3-yl]methyl]ethanamine
| Molecular Formula | C20H29NO6 |
|---|---|
| Molecular Weight | 379.20 g/mol |
| LogP | 2.44402 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 379.1995 |
| Heavy Atoms | 27 |
| Complexity | 619.114 |
Chemical Identifiers
| CAS Number | 1613-12-3 |
|---|---|
| SMILES | CCN(CC)CC1(COC1)COC2=CC=CC=C2C.C(=C\C(=O)O)\C(=O)O |
Product Overview
3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate (CAS 1613-12-3), with molecular formula C20H29NO6 and molecular weight 379.20 g/mol. IUPAC: (Z)-but-2-enedioic acid;N-ethyl-N-[[3-[(2-methylphenoxy)methyl]oxetan-3-yl]methyl]ethanamine.
Chemical Property Profile of 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate
Property Insights of 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate
The XLogP value of 2.44402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate. Following Lipinski's Rule of Five, 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate has 2 hydrogen bond donor(s) and 5 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-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate?
The CAS number of 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate is 1613-12-3.
What is the molecular formula of 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate?
The molecular formula of 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate is C20H29NO6.
What is the molecular weight of 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate?
The molecular weight of 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate is 379.20 g/mol.
Where can I buy 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate?
You can request a quote for 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate?
Yes, KEHONG BIO provides custom synthesis services for 3-Oxetanemethylamine, N,N-diethyl-3-((o-tolyloxy)methyl)-, maleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.