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4158-37-6

4158-37-6 structural image
Product Name: 2-chlorobutyronitrile
Formula: C4H6ClN
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 759

COMPUTED DESCRIPTORS

Molecular Weight 103.55 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 103.0188769 g/mol
Monoisotopic Mass 103.0188769 g/mol
Topological Polar Surface Area 23.8 Ų
Heavy Atom Count 6
Formal Charge 0
Complexity 70.9
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes