![3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose structure](/static/products/2997/29970-68-1.webp)
3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose
TL;DR: 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose (CAS 29970-68-1) is a chemical compound with molecular formula C14H13F3N2O8 and molecular weight 394.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,5-dihydroxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate
Also Known As: 3-deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose, 3-Deoxy-5-O-(4-nitrobenzoyl)-3-(2,2,2-trifluoroacetamido)pentofuranose, [4,5-dihydroxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate
| Molecular Formula | C14H13F3N2O8 |
|---|---|
| Molecular Weight | 394.06 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.0624 |
| Heavy Atoms | 27 |
| Complexity | 574.0 |
Chemical Identifiers
| CAS Number | 29970-68-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)OCC2C(C(C(O2)O)O)NC(=O)C(F)(F)F)[N+](=O)[O-] |
| InChIKey | BNTXHMKTZOEDGU-UHFFFAOYSA-N |
Product Overview
3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose (CAS 29970-68-1), with molecular formula C14H13F3N2O8 and molecular weight 394.06 g/mol. IUPAC: [4,5-dihydroxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate.
Chemical Property Profile of 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose
Property Insights of 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose. The TPSA of 151.0 Ų indicates high polarity, suggesting 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose?
The CAS number of 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose is 29970-68-1.
What is the molecular formula of 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose?
The molecular formula of 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose is C14H13F3N2O8.
What is the molecular weight of 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose?
The molecular weight of 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose is 394.06 g/mol.
Where can I buy 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose?
You can request a quote for 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose?
Yes, KEHONG BIO provides custom synthesis services for 3-Deoxy-5-o-(4-nitrobenzoyl)-3-[(trifluoroacetyl)amino]pentofuranose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.