5-Nitro-2-furanmethanediol diacetate
TL;DR: 5-Nitro-2-furanmethanediol diacetate (CAS 92-55-7) is a chemical compound with molecular formula C9H9NO7 and molecular weight 243.0379 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[acetyloxy-(5-nitrofuran-2-yl)methyl] acetate
Also Known As: 5-Nitro-2-furaldehyde diacetate, 5-Nitrofurfural diacetate, 5-Nitro-2-furanmethanediol diacetate, Nitrofurfural diacetate, (5-Nitrofuran-2-yl)methylene diacetate
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H9NO7 |
| Molecular Weight | 243.0379 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 243.0379 Da |
| Heavy Atoms | 17 |
| Complexity | 308.0 |
| SMILES | CC(=O)OC(C1=CC=C(O1)[N+](=O)[O-])OC(=O)C |
| InChIKey | HSXKWKJCZNRMJO-UHFFFAOYSA-N |
Product Description
Applications: 5-Nitro-2-furanmethanediol diacetate is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 5-Nitro-2-furanmethanediol diacetate (CAS 92-55-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
5-Nitro-2-furanmethanediol diacetate (CAS 92-55-7) is a pharmaceutical intermediate with the molecular formula C9H9NO7 and a molecular weight of 243.04 g/mol. It is also known as 5-Nitro-2-furaldehyde diacetate and 5-Nitrofurfural diacetate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 5-Nitro-2-furanmethanediol diacetate
Property Insights of 5-Nitro-2-furanmethanediol diacetate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitro-2-furanmethanediol diacetate. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-2-furanmethanediol diacetate. Following Lipinski's Rule of Five, 5-Nitro-2-furanmethanediol diacetate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Nitro-2-furanmethanediol diacetate?
The CAS number of 5-Nitro-2-furanmethanediol diacetate is 92-55-7.
What is the molecular formula of 5-Nitro-2-furanmethanediol diacetate?
The molecular formula of 5-Nitro-2-furanmethanediol diacetate is C9H9NO7.
What is the molecular weight of 5-Nitro-2-furanmethanediol diacetate?
The molecular weight of 5-Nitro-2-furanmethanediol diacetate is 243.0379 g/mol.
What are the applications of 5-Nitro-2-furanmethanediol diacetate?
5-Nitro-2-furanmethanediol diacetate is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy 5-Nitro-2-furanmethanediol diacetate?
You can request a quote for 5-Nitro-2-furanmethanediol diacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Nitro-2-furanmethanediol diacetate?
Yes, CoreyChem provides custom synthesis services for 5-Nitro-2-furanmethanediol diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.