N,N,2-三甲基-4-硝基苯胺
TL;DR: N,N,2-三甲基-4-硝基苯胺 (CAS 32417-74-6) is a chemical compound with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N,2-三甲基-4-硝基苯胺
N,N,2-trimethyl-4-nitroaniline
Also Known As: N,N,2-trimethyl-4-nitroaniline, N,N,2-TRIMETHYL-4-NITRO-ANILINE, p-Nitrodimethyl-o-toluidin, Benzenamine, N,N,2-trimethyl-4-nitro-, N,N-Dimethyl-2-methyl-4-nitroaniline
| Molecular Formula | C9H12N2O2 |
|---|---|
| Molecular Weight | 180.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.08987 |
| Heavy Atoms | 13 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 32417-74-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)[N+](=O)[O-])N(C)C |
| InChIKey | WQMWMGANNDSYBY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N,2-三甲基-4-硝基苯胺 (CAS 32417-74-6), with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol. IUPAC: N,N,2-trimethyl-4-nitroaniline.
Chemical Property Profile of N,N,2-三甲基-4-硝基苯胺
Property Insights of N,N,2-三甲基-4-硝基苯胺
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N,2-三甲基-4-硝基苯胺. With a topological polar surface area (TPSA) of 49.1 Ų, N,N,2-三甲基-4-硝基苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N,2-三甲基-4-硝基苯胺 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,2-三甲基-4-硝基苯胺?
The CAS number of N,N,2-三甲基-4-硝基苯胺 is 32417-74-6.
What is the molecular formula of N,N,2-三甲基-4-硝基苯胺?
The molecular formula of N,N,2-三甲基-4-硝基苯胺 is C9H12N2O2.
What is the molecular weight of N,N,2-三甲基-4-硝基苯胺?
The molecular weight of N,N,2-三甲基-4-硝基苯胺 is 180.09 g/mol.
Where can I buy N,N,2-三甲基-4-硝基苯胺?
You can request a quote for N,N,2-三甲基-4-硝基苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N,2-三甲基-4-硝基苯胺?
Yes, KEHONG BIO provides custom synthesis services for N,N,2-三甲基-4-硝基苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.