N,2-二甲基-4-硝基苯胺
TL;DR: N,2-二甲基-4-硝基苯胺 (CAS 10439-77-7) is a chemical compound with molecular formula C8H10N2O2 and molecular weight 166.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,2-二甲基-4-硝基苯胺
N,2-dimethyl-4-nitroaniline
Also Known As: N,2-Dimethyl-4-nitroaniline, N-Methyl-4-nitro-o-toluidine, methylnitrotoluidine, 2-(Methylamino)-5-nitrotoluene, 2,N-Dimethyl-4-nitroaniline
| Molecular Formula | C8H10N2O2 |
|---|---|
| Molecular Weight | 166.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 57.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.07423 |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 10439-77-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)[N+](=O)[O-])NC |
| InChIKey | NJYYBTRBCMPYCJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,2-二甲基-4-硝基苯胺 (CAS 10439-77-7), with molecular formula C8H10N2O2 and molecular weight 166.07 g/mol. IUPAC: N,2-dimethyl-4-nitroaniline.
Chemical Property Profile of N,2-二甲基-4-硝基苯胺
Property Insights of N,2-二甲基-4-硝基苯胺
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,2-二甲基-4-硝基苯胺. With a topological polar surface area (TPSA) of 57.9 Ų, N,2-二甲基-4-硝基苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,2-二甲基-4-硝基苯胺 has 1 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,2-二甲基-4-硝基苯胺?
The CAS number of N,2-二甲基-4-硝基苯胺 is 10439-77-7.
What is the molecular formula of N,2-二甲基-4-硝基苯胺?
The molecular formula of N,2-二甲基-4-硝基苯胺 is C8H10N2O2.
What is the molecular weight of N,2-二甲基-4-硝基苯胺?
The molecular weight of N,2-二甲基-4-硝基苯胺 is 166.07 g/mol.
Where can I buy N,2-二甲基-4-硝基苯胺?
You can request a quote for N,2-二甲基-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,2-二甲基-4-硝基苯胺?
Yes, KEHONG BIO provides custom synthesis services for N,2-二甲基-4-硝基苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.