2-(Furan-2-carbonyl)-2-(3-nitrophenyl)butanoate

Base Information

• Chemical Name: 2-(Furan-2-carbonyl)-2-(3-nitrophenyl)butanoate
• CAS No.: 887411-69-0
• Molecular Formula: C15H13 N O6
• Molecular Weight: 303.27
• DSSTox Substance ID: DTXSID10695446
• Mol file: 887411-69-0.mol

Synonyms:DTXSID10695446;2-(furan-2-carbonyl)-2-(3-nitrophenyl)butanoate

Chemical Property of 2-(Furan-2-carbonyl)-2-(3-nitrophenyl)butanoate

Chemical Property:

• Vapor Pressure: 1E-08mmHg at 25°C
• Refractive Index: 1.557
• Boiling Point: 462.3°C at 760 mmHg
• PKA: 9.43±0.48(Predicted)
• Flash Point: 233.4°C
• PSA: 102.33000
• Density: 1.296g/cm³
• LogP: 3.51390
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 302.06646210
• Heavy Atom Count: 22
• Complexity: 454

Purity/Quality:

95% ^*data from raw suppliers

ETHYL-2-[5-(3-NITROPHENYL)]FUROYL-ACETATE 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C1=CC(=CC=C1)[N+](=O)[O-])(C(=O)C2=CC=CO2)C(=O)[O-]

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