![[4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate structure](/static/products/7150/71507-97-6.webp)
[4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate
TL;DR: [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate (CAS 71507-97-6) is a chemical compound with molecular formula C18H17F3N2O10 and molecular weight 478.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate
Also Known As: [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate|1,2-Di-O-acetyl-3-deoxy-5-O-(4-nitrobenzoyl)-3-(2,2,2-trifluoroacetamido)pentofuranose
| Molecular Formula | C18H17F3N2O10 |
|---|---|
| Molecular Weight | 478.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 9 |
| Exact Mass | 478.08353 |
| Heavy Atoms | 33 |
| Complexity | 776.0 |
Chemical Identifiers
| CAS Number | 71507-97-6 |
|---|---|
| SMILES | CC(=O)OC1C(C(OC1OC(=O)C)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C(F)(F)F |
| InChIKey | KJYCQWGFGOHIQP-UHFFFAOYSA-N |
Product Overview
[4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate (CAS 71507-97-6), with molecular formula C18H17F3N2O10 and molecular weight 478.08 g/mol. IUPAC: [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate.
Chemical Property Profile of [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate
Property Insights of [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate. The TPSA of 163.0 Ų indicates high polarity, suggesting [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate has 1 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate?
The CAS number of [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate is 71507-97-6.
What is the molecular formula of [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate?
The molecular formula of [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate is C18H17F3N2O10.
What is the molecular weight of [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate?
The molecular weight of [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate is 478.08 g/mol.
Where can I buy [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate?
You can request a quote for [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [4,5-diacetyloxy-3-[(2,2,2-trifluoroacetyl)amino]oxolan-2-yl]methyl 4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.