3,5-二硝基苯甲酰胺
TL;DR: 3,5-二硝基苯甲酰胺 (CAS 121-81-3) is a chemical compound with molecular formula C7H5N3O5 and molecular weight 211.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-二硝基苯甲酰胺
3,5-dinitrobenzamide
Also Known As: 3,5-Dinitrobenzamide, nitromide, Tristat, Unistat, Nitroamide
| Molecular Formula | C7H5N3O5 |
|---|---|
| Molecular Weight | 211.02 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 211.02292 |
| Heavy Atoms | 15 |
| Complexity | 272.0 |
| Vapor Pressure | 0.00000016 [mmHg] |
Chemical Identifiers
| CAS Number | 121-81-3 |
|---|---|
| SMILES | C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)N |
| InChIKey | UUKWKUSGGZNXGA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-二硝基苯甲酰胺 (CAS 121-81-3), with molecular formula C7H5N3O5 and molecular weight 211.02 g/mol. IUPAC: 3,5-dinitrobenzamide.
Chemical Property Profile of 3,5-二硝基苯甲酰胺
Property Insights of 3,5-二硝基苯甲酰胺
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-二硝基苯甲酰胺. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-二硝基苯甲酰胺. Following Lipinski's Rule of Five, 3,5-Dinitrobenzamide has 1 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 3,5-Dinitrobenzamide?
The CAS number of 3,5-Dinitrobenzamide is 121-81-3.
What is the molecular formula of 3,5-Dinitrobenzamide?
The molecular formula of 3,5-Dinitrobenzamide is C7H5N3O5.
What is the molecular weight of 3,5-Dinitrobenzamide?
The molecular weight of 3,5-Dinitrobenzamide is 211.02 g/mol.
Where can I buy 3,5-Dinitrobenzamide?
You can request a quote for 3,5-Dinitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dinitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.