![N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine structure](/static/products/116/116791-94-7.png)
N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine
TL;DR: N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine (CAS 116791-94-7) is a chemical compound with molecular formula C12H18N2O3 and molecular weight 238.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine
Also Known As: diethyl-(2-methoxy-5-nitro-benzyl)-amine, N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine, N-ethyl-N-[(2-methoxy-5-nitro-phenyl)methyl]ethanamine
| Molecular Formula | C12H18N2O3 |
|---|---|
| Molecular Weight | 238.13 g/mol |
| LogP | 2.4452 |
| Topological Polar Surface Area | 55.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 238.13174 |
| Heavy Atoms | 17 |
| Complexity | 389.33716 |
Chemical Identifiers
| CAS Number | 116791-94-7 |
|---|---|
| SMILES | CCN(CC)CC1=C(C=CC(=C1)[N+](=O)[O-])OC |
Product Overview
N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine (CAS 116791-94-7), with molecular formula C12H18N2O3 and molecular weight 238.13 g/mol. IUPAC: N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine.
Chemical Property Profile of N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine
Property Insights of N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine
The XLogP value of 2.4452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine. With a topological polar surface area (TPSA) of 55.61 Ų, N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine has 0 hydrogen bond donor(s) and 4 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 N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine?
The CAS number of N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine is 116791-94-7.
What is the molecular formula of N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine?
The molecular formula of N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine is C12H18N2O3.
What is the molecular weight of N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine?
The molecular weight of N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine is 238.13 g/mol.
Where can I buy N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine?
You can request a quote for N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-ethyl-N-[(2-methoxy-5-nitrophenyl)methyl]ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.