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Home > Encyclopedia > Ethanone, 1-(3-nitro-5-isoxazolyl)- (9CI)

Ethanone, 1-(3-nitro-5-isoxazolyl)- (9CI)

Ethanone, 1-(3-nitro-5-isoxazolyl)- (9CI) structure

Ethanone, 1-(3-nitro-5-isoxazolyl)- (9CI) 

structure
  • CAS No:

    54468-91-6

  • Formula:

    C5H4N2O4

  • Chemical Name:

    Ethanone, 1-(3-nitro-5-isoxazolyl)- (9CI)

  • Synonyms:

    1-(3-nitroisoxazol-5-yl)ethanone;1-(3-nitro-1,2-oxazol-5-yl)ethanone;5-Acetyl-3-nitroisoxazole;SCHEMBL6883982

Ethanone, 1-(3-nitro-5-isoxazolyl)- (9CI) Basic Attributes

156.09626

156.017

Characteristics

88.9

0.5

1.434±0.06 g/cm3(Predicted)

70-72 °C

Computed Properties

Molecular Weight:156.10
XLogP3:0.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:156.01710661
Monoisotopic Mass:156.01710661
Topological Polar Surface Area:88.9
Heavy Atom Count:11
Complexity:187
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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