4-Amino-3-nitro-5-methylaniline
TL;DR: 4-Amino-3-nitro-5-methylaniline (CAS 155379-82-1) is a chemical compound with molecular formula C7H9N3O2 and molecular weight 167.06947 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-6-nitrobenzene-1,4-diamine
Also Known As: 4-Amino-3-nitro-5-methylaniline, 2-methyl-6-nitrobenzene-1,4-diamine, 1,4-Benzenediamine, 2-methyl-6-nitro-, 2-Methyl-6-nitro-1,4-benzenediamine, 1,4-Benzenediamine,2-methyl-6-nitro
Technical Specifications
| Molecular Formula | C7H9N3O2 |
| Molecular Weight | 167.06947 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 97.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 167.06947 Da |
| Heavy Atoms | 12 |
| Complexity | 180.0 |
| SMILES | CC1=CC(=CC(=C1N)[N+](=O)[O-])N |
| InChIKey | WJADKDGCBYAUMT-UHFFFAOYSA-N |
Chemical Property Profile of 4-Amino-3-nitro-5-methylaniline
Property Insights of 4-Amino-3-nitro-5-methylaniline
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-3-nitro-5-methylaniline. The TPSA of 97.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-3-nitro-5-methylaniline. Following Lipinski's Rule of Five, 4-Amino-3-nitro-5-methylaniline has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Amino-3-nitro-5-methylaniline?
The CAS number of 4-Amino-3-nitro-5-methylaniline is 155379-82-1.
What is the molecular formula of 4-Amino-3-nitro-5-methylaniline?
The molecular formula of 4-Amino-3-nitro-5-methylaniline is C7H9N3O2.
What is the molecular weight of 4-Amino-3-nitro-5-methylaniline?
The molecular weight of 4-Amino-3-nitro-5-methylaniline is 167.06947 g/mol.
Where can I buy 4-Amino-3-nitro-5-methylaniline?
You can request a quote for 4-Amino-3-nitro-5-methylaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Amino-3-nitro-5-methylaniline?
Yes, CoreyChem provides custom synthesis services for 4-Amino-3-nitro-5-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.