Benzenamine, 2-methyl-N-(4-nitrophenyl)-
TL;DR: Benzenamine, 2-methyl-N-(4-nitrophenyl)- (CAS 17008-65-0) is a chemical compound with molecular formula C13H12N2O2 and molecular weight 228.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-(4-nitrophenyl)aniline
Also Known As: Bufarenogin, 2-methyl-N-(4-nitrophenyl)aniline, Benzenamine, 2-methyl-N-(4-nitrophenyl)-, Benzenamine,2-methyl-N-(4-nitrophenyl)
| Molecular Formula | C13H12N2O2 |
|---|---|
| Molecular Weight | 228.09 g/mol |
| LogP | 3.64682 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.08987 |
| Heavy Atoms | 17 |
| Complexity | 535.37067 |
Chemical Identifiers
| CAS Number | 17008-65-0 |
|---|---|
| SMILES | CC1=CC=CC=C1NC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
Benzenamine, 2-methyl-N-(4-nitrophenyl)- (CAS 17008-65-0), with molecular formula C13H12N2O2 and molecular weight 228.09 g/mol. IUPAC: 2-methyl-N-(4-nitrophenyl)aniline.
Chemical Property Profile of Benzenamine, 2-methyl-N-(4-nitrophenyl)-
Property Insights of Benzenamine, 2-methyl-N-(4-nitrophenyl)-
The XLogP value of 3.64682 indicates that Benzenamine, 2-methyl-N-(4-nitrophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.17 Ų, Benzenamine, 2-methyl-N-(4-nitrophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, 2-methyl-N-(4-nitrophenyl)- 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 Benzenamine, 2-methyl-N-(4-nitrophenyl)-?
The CAS number of Benzenamine, 2-methyl-N-(4-nitrophenyl)- is 17008-65-0.
What is the molecular formula of Benzenamine, 2-methyl-N-(4-nitrophenyl)-?
The molecular formula of Benzenamine, 2-methyl-N-(4-nitrophenyl)- is C13H12N2O2.
What is the molecular weight of Benzenamine, 2-methyl-N-(4-nitrophenyl)-?
The molecular weight of Benzenamine, 2-methyl-N-(4-nitrophenyl)- is 228.09 g/mol.
Where can I buy Benzenamine, 2-methyl-N-(4-nitrophenyl)-?
You can request a quote for Benzenamine, 2-methyl-N-(4-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, 2-methyl-N-(4-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, 2-methyl-N-(4-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.