3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide
TL;DR: 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide (CAS 304458-26-2) is a chemical compound with molecular formula C10H8F3N3O5 and molecular weight 307.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide
Also Known As: 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide, 3,5-DINITRO-N-(2,2,2-TRIFLUORO-1-METHYL-ETHYL)-BENZAMIDE
| Molecular Formula | C10H8F3N3O5 |
|---|---|
| Molecular Weight | 307.04 g/mol |
| LogP | 2.1836 |
| Topological Polar Surface Area | 115.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.0416 |
| Heavy Atoms | 21 |
| Complexity | 569.8414 |
Chemical Identifiers
| CAS Number | 304458-26-2 |
|---|---|
| SMILES | CC(C(F)(F)F)NC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide (CAS 304458-26-2), with molecular formula C10H8F3N3O5 and molecular weight 307.04 g/mol. IUPAC: 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide.
Chemical Property Profile of 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide
Property Insights of 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide
The XLogP value of 2.1836 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide. The TPSA of 115.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide. Following Lipinski's Rule of Five, 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide 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-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide?
The CAS number of 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide is 304458-26-2.
What is the molecular formula of 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide?
The molecular formula of 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide is C10H8F3N3O5.
What is the molecular weight of 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide?
The molecular weight of 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide is 307.04 g/mol.
Where can I buy 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide?
You can request a quote for 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-dinitro-N-(1,1,1-trifluoropropan-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.