3,4-Diphenyl-5-nitro-2-acetylfuran
TL;DR: 3,4-Diphenyl-5-nitro-2-acetylfuran (CAS 52101-49-2) is a chemical compound with molecular formula C18H13NO4 and molecular weight 307.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-nitro-3,4-diphenylfuran-2-yl)ethanone
Also Known As: 3,4-Diphenyl-5-nitro-2-acetylfuran, Furan, 2-acetyl-3,4-diphenyl-5-nitro-, 1-(5-nitro-3,4-diphenylfuran-2-yl)ethanone, 1-(3,4-Diphenyl-5-nitro-2-furanyl)ethanone, 3,4-Diphenyl -5-nitro-2-acetylfuran
| Molecular Formula | C18H13NO4 |
|---|---|
| Molecular Weight | 307.08 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.08447 |
| Heavy Atoms | 23 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 52101-49-2 |
|---|---|
| SMILES | CC(=O)C1=C(C(=C(O1)[N+](=O)[O-])C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | DJUQPRHVVNQSIS-UHFFFAOYSA-N |
Product Overview
3,4-Diphenyl-5-nitro-2-acetylfuran (CAS 52101-49-2), with molecular formula C18H13NO4 and molecular weight 307.08 g/mol. IUPAC: 1-(5-nitro-3,4-diphenylfuran-2-yl)ethanone.
Chemical Property Profile of 3,4-Diphenyl-5-nitro-2-acetylfuran
Property Insights of 3,4-Diphenyl-5-nitro-2-acetylfuran
The XLogP value of 4.4 indicates that 3,4-Diphenyl-5-nitro-2-acetylfuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Diphenyl-5-nitro-2-acetylfuran. Following Lipinski's Rule of Five, 3,4-Diphenyl-5-nitro-2-acetylfuran has 0 hydrogen bond donor(s) and 4 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 3,4-Diphenyl-5-nitro-2-acetylfuran?
The CAS number of 3,4-Diphenyl-5-nitro-2-acetylfuran is 52101-49-2.
What is the molecular formula of 3,4-Diphenyl-5-nitro-2-acetylfuran?
The molecular formula of 3,4-Diphenyl-5-nitro-2-acetylfuran is C18H13NO4.
What is the molecular weight of 3,4-Diphenyl-5-nitro-2-acetylfuran?
The molecular weight of 3,4-Diphenyl-5-nitro-2-acetylfuran is 307.08 g/mol.
Where can I buy 3,4-Diphenyl-5-nitro-2-acetylfuran?
You can request a quote for 3,4-Diphenyl-5-nitro-2-acetylfuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Diphenyl-5-nitro-2-acetylfuran?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Diphenyl-5-nitro-2-acetylfuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.