N,N-diethylaniline;2,4,6-trinitrophenol
TL;DR: N,N-diethylaniline;2,4,6-trinitrophenol (CAS 154381-70-1) is a chemical compound with molecular formula C16H18N4O7 and molecular weight 378.11755 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethylaniline;2,4,6-trinitrophenol
Also Known As: N,N-diethyl-aniline picrate, N,N-diethyl-aniline; picrate, N,N-diethylaniline;2,4,6-trinitrophenol, N,N-diethylaniline; 2,4,6-trinitrophenol, 2,4,6-trinitrophenol- n,n-diethylaniline(1:1)
Technical Specifications
| Molecular Formula | C16H18N4O7 |
| Molecular Weight | 378.11755 g/mol |
| XLogP | 3.6496 |
| Topological Polar Surface Area (TPSA) | 161.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 378.11755 Da |
| Heavy Atoms | 27 |
| Complexity | 383.0 |
| SMILES | CCN(CC)C1=CC=CC=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | UOAVDMOPQKADNE-UHFFFAOYSA-N |
Chemical Property Profile of N,N-diethylaniline;2,4,6-trinitrophenol
Property Insights of N,N-diethylaniline;2,4,6-trinitrophenol
The XLogP value of 3.6496 indicates that N,N-diethylaniline;2,4,6-trinitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 161.0 Ų indicates high polarity, suggesting N,N-diethylaniline;2,4,6-trinitrophenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N,N-diethylaniline;2,4,6-trinitrophenol has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N,N-diethylaniline;2,4,6-trinitrophenol?
The CAS number of N,N-diethylaniline;2,4,6-trinitrophenol is 154381-70-1.
What is the molecular formula of N,N-diethylaniline;2,4,6-trinitrophenol?
The molecular formula of N,N-diethylaniline;2,4,6-trinitrophenol is C16H18N4O7.
What is the molecular weight of N,N-diethylaniline;2,4,6-trinitrophenol?
The molecular weight of N,N-diethylaniline;2,4,6-trinitrophenol is 378.11755 g/mol.
Where can I buy N,N-diethylaniline;2,4,6-trinitrophenol?
You can request a quote for N,N-diethylaniline;2,4,6-trinitrophenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N,N-diethylaniline;2,4,6-trinitrophenol?
Yes, CoreyChem provides custom synthesis services for N,N-diethylaniline;2,4,6-trinitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.