1-Azido-4,5-dimethyl-2-nitrobenzene
TL;DR: 1-Azido-4,5-dimethyl-2-nitrobenzene (CAS 1027598-42-0) is a chemical compound with molecular formula C8H8N4O2 and molecular weight 192.06473 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-azido-4,5-dimethyl-2-nitrobenzene
Also Known As: 1-azido-4,5-dimethyl-2-nitrobenzene, 1-azido-4,5-dimethyl-2-nitro-benzene
Technical Specifications
| Molecular Formula | C8H8N4O2 |
| Molecular Weight | 192.06473 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 60.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.06473 Da |
| Heavy Atoms | 14 |
| Complexity | 269.0 |
| SMILES | CC1=CC(=C(C=C1C)[N+](=O)[O-])N=[N+]=[N-] |
| InChIKey | LUDTZTYDJAYXSR-UHFFFAOYSA-N |
Chemical Property Profile of 1-Azido-4,5-dimethyl-2-nitrobenzene
Property Insights of 1-Azido-4,5-dimethyl-2-nitrobenzene
The XLogP value of 3.4 indicates that 1-Azido-4,5-dimethyl-2-nitrobenzene 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 1-Azido-4,5-dimethyl-2-nitrobenzene. Following Lipinski's Rule of Five, 1-Azido-4,5-dimethyl-2-nitrobenzene 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
What is the CAS number of 1-Azido-4,5-dimethyl-2-nitrobenzene?
The CAS number of 1-Azido-4,5-dimethyl-2-nitrobenzene is 1027598-42-0.
What is the molecular formula of 1-Azido-4,5-dimethyl-2-nitrobenzene?
The molecular formula of 1-Azido-4,5-dimethyl-2-nitrobenzene is C8H8N4O2.
What is the molecular weight of 1-Azido-4,5-dimethyl-2-nitrobenzene?
The molecular weight of 1-Azido-4,5-dimethyl-2-nitrobenzene is 192.06473 g/mol.
Where can I buy 1-Azido-4,5-dimethyl-2-nitrobenzene?
You can request a quote for 1-Azido-4,5-dimethyl-2-nitrobenzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Azido-4,5-dimethyl-2-nitrobenzene?
Yes, CoreyChem provides custom synthesis services for 1-Azido-4,5-dimethyl-2-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.