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Home > Encyclopedia > Benzeneacetonitrile, 4-(1-methylethyl)-alpha-oxo- (9CI)

Benzeneacetonitrile, 4-(1-methylethyl)-alpha-oxo- (9CI)

Benzeneacetonitrile, 4-(1-methylethyl)-alpha-oxo- (9CI) structure

Benzeneacetonitrile, 4-(1-methylethyl)-alpha-oxo- (9CI) 

structure
  • CAS No:

    66582-15-8

  • Formula:

    C11H11NO

  • Chemical Name:

    Benzeneacetonitrile, 4-(1-methylethyl)-alpha-oxo- (9CI)

  • Synonyms:

    CTK5C4920;DTXSID60667491;(4-Isopropylphenyl)(oxo)acetonitrile;ZINC100268219;4-(Propan-2-yl)benzene-1-carbonyl cyanide;BENZENEACETONITRILE, 4-(1-METHYLETHYL)-ALPHA-OXO-

Benzeneacetonitrile, 4-(1-methylethyl)-alpha-oxo- (9CI) Basic Attributes

173.21114

173.084

DTXSID60667491

Characteristics

40.9

3.5

Computed Properties

Molecular Weight:173.21
XLogP3:3.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:173.084063974
Monoisotopic Mass:173.084063974
Topological Polar Surface Area:40.9
Heavy Atom Count:13
Complexity:228
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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