4-Methyl-3,5-dinitrobenzoyl azide
TL;DR: 4-Methyl-3,5-dinitrobenzoyl azide (CAS 6633-29-0) is a chemical compound with molecular formula C8H5N5O5 and molecular weight 251.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3,5-dinitrobenzoyl azide
Also Known As: NCIOpen2_002401, 4-methyl-3,5-dinitrobenzoyl azide
| Molecular Formula | C8H5N5O5 |
|---|---|
| Molecular Weight | 251.03 g/mol |
| LogP | 2.26192 |
| Topological Polar Surface Area | 152.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.02907 |
| Heavy Atoms | 18 |
| Complexity | 568.8904 |
Chemical Identifiers
| CAS Number | 6633-29-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)N=[N+]=[N-])[N+](=O)[O-] |
Product Overview
4-Methyl-3,5-dinitrobenzoyl azide (CAS 6633-29-0), with molecular formula C8H5N5O5 and molecular weight 251.03 g/mol. IUPAC: 4-methyl-3,5-dinitrobenzoyl azide.
Chemical Property Profile of 4-Methyl-3,5-dinitrobenzoyl azide
Property Insights of 4-Methyl-3,5-dinitrobenzoyl azide
The XLogP value of 2.26192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-3,5-dinitrobenzoyl azide. The TPSA of 152.11 Ų indicates high polarity, suggesting 4-Methyl-3,5-dinitrobenzoyl azide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Methyl-3,5-dinitrobenzoyl azide has 0 hydrogen bond donor(s) and 5 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-3,5-dinitrobenzoyl azide?
The CAS number of 4-Methyl-3,5-dinitrobenzoyl azide is 6633-29-0.
What is the molecular formula of 4-Methyl-3,5-dinitrobenzoyl azide?
The molecular formula of 4-Methyl-3,5-dinitrobenzoyl azide is C8H5N5O5.
What is the molecular weight of 4-Methyl-3,5-dinitrobenzoyl azide?
The molecular weight of 4-Methyl-3,5-dinitrobenzoyl azide is 251.03 g/mol.
Where can I buy 4-Methyl-3,5-dinitrobenzoyl azide?
You can request a quote for 4-Methyl-3,5-dinitrobenzoyl 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-3,5-dinitrobenzoyl azide?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-3,5-dinitrobenzoyl azide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.