1,4-Dimethylamino-4-nitrostilbene
TL;DR: 1,4-Dimethylamino-4-nitrostilbene (CAS 127424-42-4) is a chemical compound with molecular formula C16H16N2O2 and molecular weight 268.1212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dimethyl-4-[(E)-2-(4-nitrophenyl)ethenyl]aniline
Also Known As: 4-Dimethylamino-4'-nitrostilbene, DANS, Amino-Nitrostilbene, n,n-dimethyl-4-(4-nitrostyryl)aniline, 1,4-Dimethylamino-4-nitrostilbene
Technical Specifications
| Molecular Formula | C16H16N2O2 |
| Molecular Weight | 268.1212 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.1212 Da |
| Heavy Atoms | 20 |
| Complexity | 333.0 |
| SMILES | CN(C)C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | NVLSIZITFJRWPY-ONEGZZNKSA-N |
Chemical Property Profile of 1,4-Dimethylamino-4-nitrostilbene
Property Insights of 1,4-Dimethylamino-4-nitrostilbene
The XLogP value of 4.5 indicates that 1,4-Dimethylamino-4-nitrostilbene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.1 Ų, 1,4-Dimethylamino-4-nitrostilbene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dimethylamino-4-nitrostilbene 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
What is the CAS number of 1,4-Dimethylamino-4-nitrostilbene?
The CAS number of 1,4-Dimethylamino-4-nitrostilbene is 127424-42-4.
What is the molecular formula of 1,4-Dimethylamino-4-nitrostilbene?
The molecular formula of 1,4-Dimethylamino-4-nitrostilbene is C16H16N2O2.
What is the molecular weight of 1,4-Dimethylamino-4-nitrostilbene?
The molecular weight of 1,4-Dimethylamino-4-nitrostilbene is 268.1212 g/mol.
Where can I buy 1,4-Dimethylamino-4-nitrostilbene?
You can request a quote for 1,4-Dimethylamino-4-nitrostilbene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,4-Dimethylamino-4-nitrostilbene?
Yes, CoreyChem provides custom synthesis services for 1,4-Dimethylamino-4-nitrostilbene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.