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Home > Encyclopedia > Benzoyl chloride, 2-(cyanomethyl)- (9CI)

Benzoyl chloride, 2-(cyanomethyl)- (9CI)

Benzoyl chloride, 2-(cyanomethyl)- (9CI) structure

Benzoyl chloride, 2-(cyanomethyl)- (9CI) 

structure
  • CAS No:

    690229-60-8

  • Formula:

    C9H6ClNO

  • Chemical Name:

    Benzoyl chloride, 2-(cyanomethyl)- (9CI)

  • Synonyms:

    2-(Cyanomethyl)benzoyl chloride;2-(CYANOMETHYL)-BENZOYL CHLORIDE;SCHEMBL8965146;CTK7C9828;DTXSID40477858;SBB053617;ZINC20357958;AKOS006330481

Benzoyl chloride, 2-(cyanomethyl)- (9CI) Basic Attributes

179.60304

179.014

DTXSID40477858

Characteristics

40.9

2.1

1.264±0.06 g/cm3(Predicted)

47 °C

Computed Properties

Molecular Weight:179.60
XLogP3:2.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:179.0137915
Monoisotopic Mass:179.0137915
Topological Polar Surface Area:40.9
Heavy Atom Count:12
Complexity:218
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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