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Home > Encyclopedia > 1,2-BENZISOXAZOL-3(2H)-ONE, 5-NITRO-

1,2-BENZISOXAZOL-3(2H)-ONE, 5-NITRO-

1,2-BENZISOXAZOL-3(2H)-ONE, 5-NITRO- structure

1,2-BENZISOXAZOL-3(2H)-ONE, 5-NITRO- 

structure
  • CAS No:

    36238-80-9

  • Formula:

    C7H4N2O4

  • Chemical Name:

    1,2-BENZISOXAZOL-3(2H)-ONE, 5-NITRO-

  • Synonyms:

    5-Nitrobenzo[d]isoxazol-3-ol;1,2-Benzisoxazol-3(2H)-one, 5-nitro-;3-hydroxy-5-nitro-1,2-benzisoxazole;CHEMBL472830;SCHEMBL6588863;5-nitro-1,2-benzoxazol-3-ol;5-nitro-1,2-benzoxazol-3-one;BDBM23172;CTK1B0144;DTXSID10503618

1,2-BENZISOXAZOL-3(2H)-ONE, 5-NITRO- Basic Attributes

180.119

180.017105

DTXSID10503618

2934999090

Characteristics

84.2

0.72

1.6±0.1 g/cm3

178 °C

411.9±25.0 °C at 760 mmHg

202.9±23.2 °C

1.710

Computed Properties

Molecular Weight:180.12
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:180.01710661
Monoisotopic Mass:180.01710661
Topological Polar Surface Area:84.2
Heavy Atom Count:13
Complexity:249
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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