Ethyl 4-cyano-2-fluoro-2-nitrobutanoate

Base Information

• Chemical Name: Ethyl 4-cyano-2-fluoro-2-nitrobutanoate
• CAS No.: 110683-81-3
• Molecular Formula: C7H9FN2O4
• Molecular Weight: 204.15600
• DSSTox Substance ID: DTXSID20552132
• Nikkaji Number: J246.275C
• Mol file: 110683-81-3.mol

Synonyms:Ethyl 4-cyano-2-fluoro-2-nitrobutanoate;110683-81-3;DTXSID20552132

Chemical Property of Ethyl 4-cyano-2-fluoro-2-nitrobutanoate

Chemical Property:

• Boiling Point: 315.9±42.0 °C(Predicted)
• PSA: 95.91000
• Density: 1.282±0.06 g/cm3(Predicted)
• LogP: 1.31898
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 204.05463493
• Heavy Atom Count: 14
• Complexity: 279

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(CCC#N)([N+](=O)[O-])F

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