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Home > Encyclopedia > Acetic acid, [(cyanomethyl)methylamino]oxo-, methyl ester (9CI)

Acetic acid, [(cyanomethyl)methylamino]oxo-, methyl ester (9CI)

Acetic acid, [(cyanomethyl)methylamino]oxo-, methyl ester (9CI) structure

Acetic acid, [(cyanomethyl)methylamino]oxo-, methyl ester (9CI) 

structure
  • CAS No:

    115714-36-8

  • Formula:

    C6H8N2O3

  • Chemical Name:

    Acetic acid, [(cyanomethyl)methylamino]oxo-, methyl ester (9CI)

  • Synonyms:

    Methyl [(cyanomethyl)(methyl)amino](oxo)acetate;ZINC39057910

Acetic acid, [(cyanomethyl)methylamino]oxo-, methyl ester (9CI) Basic Attributes

156.13932

156.053

Characteristics

70.4

-0.2

1.212±0.06 g/cm3(Predicted)

251.0±42.0 °C(Predicted)

Computed Properties

Molecular Weight:156.14
XLogP3:-0.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:156.05349212
Monoisotopic Mass:156.05349212
Topological Polar Surface Area:70.4
Heavy Atom Count:11
Complexity:215
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of Acetic acid, [(cyanomethyl)methylamino]oxo-, methyl ester (9CI)

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