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63812-08-8

63812-08-8 structural image
Product Name: 2-ISOCYANO-OCTANE
Formula: C9H17N
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COMPUTED DESCRIPTORS

Molecular Weight 139.24 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 5
Exact Mass 139.136099547 g/mol
Monoisotopic Mass 139.136099547 g/mol
Topological Polar Surface Area 4.4 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 109
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