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6945-87-5

6945-87-5 structural image
Product Name: 2-CHLORO-2-CYANO-BICYCLO(2,2,1)-HEPT-5-ENE
Formula: C8H8ClN
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1153 1146

COMPUTED DESCRIPTORS

Molecular Weight 153.61 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 153.0345270 g/mol
Monoisotopic Mass 153.0345270 g/mol
Topological Polar Surface Area 23.8 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 237
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes