4-Nitrobutyl acetate

Base Information

• Chemical Name: 4-Nitrobutyl acetate
• CAS No.: 21461-50-7
• Molecular Formula: C6H11NO4
• Molecular Weight: 161.16
• NSC Number: 106860
• DSSTox Substance ID: DTXSID20296009
• Nikkaji Number: J937.712C
• Wikidata: Q82036301
• Mol file: 21461-50-7.mol

Synonyms:4-nitrobutyl acetate;21461-50-7;1-Butanol,4-nitro-, 1-acetate;NSC106860;SCHEMBL11429849;DTXSID20296009;MFCD21608331;NSC-106860;SY266596

Chemical Property of 4-Nitrobutyl acetate

Chemical Property:

• Vapor Pressure: 0.0402mmHg at 25°C
• Refractive Index: 1.436
• Boiling Point: 239.4 °C at 760 mmHg
• Flash Point: 107.6 °C
• Density: 1.12 g/cm³
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 161.06880783
• Heavy Atom Count: 11
• Complexity: 140

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CC(=O)OCCCC[N+](=O)[O-]