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Home > Encyclopedia > α-Oxo-2-benzothiazolepropanoic acid

α-Oxo-2-benzothiazolepropanoic acid

α-Oxo-2-benzothiazolepropanoic acid structure

α-Oxo-2-benzothiazolepropanoic acid 

structure
  • CAS No:

    29198-88-7

  • Formula:

    C10H7NO3S

  • Chemical Name:

    α-Oxo-2-benzothiazolepropanoic acid

  • Synonyms:

    2-Benzothiazolepropanoic acid,α-oxo-;2-Benzothiazolepyruvic acid;α-Oxo-2-benzothiazolepropanoic acid;3-Benzothiazol-2-yl-2-oxo-propionic acid;3-(1,3-Benzothiazol-2-yl)-2-oxopropanoic acid

α-Oxo-2-benzothiazolepropanoic acid Basic Attributes

221.23

221.23

DTXSID60663352

Characteristics

95.5

1.8

1.501±0.06 g/cm3(Predicted)

173 °C (decomp)

Computed Properties

Molecular Weight:221.23
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:221.01466426
Monoisotopic Mass:221.01466426
Topological Polar Surface Area:95.5
Heavy Atom Count:15
Complexity:282
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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