![N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline structure](/static/products/6446/64462-51-7.webp)
N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline
TL;DR: N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline (CAS 64462-51-7) is a chemical compound with molecular formula C12H16N2O2 and molecular weight 220.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-4-[(E)-2-nitroethenyl]aniline
Also Known As: DEANST, N,N-diethyl-4-[(E)-2-nitrovinyl]aniline, N,N-diethyl-4-(2-nitroethenyl)aniline, N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline, (E)-N,N-diethyl-4-(2-nitrovinyl)aniline
| Molecular Formula | C12H16N2O2 |
|---|---|
| Molecular Weight | 220.12 g/mol |
| LogP | 2.7802 |
| Topological Polar Surface Area | 46.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 220.12119 |
| Heavy Atoms | 16 |
| Complexity | 367.11008 |
Chemical Identifiers
| CAS Number | 64462-51-7 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)/C=C/[N+](=O)[O-] |
Product Overview
N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline (CAS 64462-51-7), with molecular formula C12H16N2O2 and molecular weight 220.12 g/mol. IUPAC: N,N-diethyl-4-[(E)-2-nitroethenyl]aniline.
Chemical Property Profile of N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline
Property Insights of N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline
The XLogP value of 2.7802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline. With a topological polar surface area (TPSA) of 46.38 Ų, N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline has 0 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 N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline?
The CAS number of N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline is 64462-51-7.
What is the molecular formula of N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline?
The molecular formula of N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline is C12H16N2O2.
What is the molecular weight of N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline?
The molecular weight of N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline is 220.12 g/mol.
Where can I buy N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline?
You can request a quote for N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diethyl-4-[(E)-2-nitroethenyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.