4-Methyl-2-nitrophenyl azide
TL;DR: 4-Methyl-2-nitrophenyl azide (CAS 20615-75-2) is a chemical compound with molecular formula C7H6N4O2 and molecular weight 178.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-azido-4-methyl-2-nitrobenzene
Also Known As: 3-Nitro-4-azidotoluene, 1-azido-4-methyl-2-nitrobenzene, 4-Methyl-2-nitrophenyl azide, Toluene, 4-azido-3-nitro-, 2-Nitro-4-methylphenyl azide
| Molecular Formula | C7H6N4O2 |
|---|---|
| Molecular Weight | 178.05 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 60.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.04907 |
| Heavy Atoms | 13 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 20615-75-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N=[N+]=[N-])[N+](=O)[O-] |
| InChIKey | GYBBGEGMFYCHPG-UHFFFAOYSA-N |
Product Overview
4-Methyl-2-nitrophenyl azide (CAS 20615-75-2), with molecular formula C7H6N4O2 and molecular weight 178.05 g/mol. IUPAC: 1-azido-4-methyl-2-nitrobenzene.
Chemical Property Profile of 4-Methyl-2-nitrophenyl azide
Property Insights of 4-Methyl-2-nitrophenyl azide
The XLogP value of 3.1 indicates that 4-Methyl-2-nitrophenyl azide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-2-nitrophenyl azide. Following Lipinski's Rule of Five, 4-Methyl-2-nitrophenyl azide has 0 hydrogen bond donor(s) and 4 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 4-Methyl-2-nitrophenyl azide?
The CAS number of 4-Methyl-2-nitrophenyl azide is 20615-75-2.
What is the molecular formula of 4-Methyl-2-nitrophenyl azide?
The molecular formula of 4-Methyl-2-nitrophenyl azide is C7H6N4O2.
What is the molecular weight of 4-Methyl-2-nitrophenyl azide?
The molecular weight of 4-Methyl-2-nitrophenyl azide is 178.05 g/mol.
Where can I buy 4-Methyl-2-nitrophenyl azide?
You can request a quote for 4-Methyl-2-nitrophenyl azide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-2-nitrophenyl azide?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-2-nitrophenyl azide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.