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180978-26-1

180978-26-1 structural image
Product Name: Cyclohexanecarbonitrile, 5-methyl-2-(1-methylethyl)-, (1S,2S,5R)- (9CI)
Formula: C11H19N
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COMPUTED DESCRIPTORS

Molecular Weight 165.27 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 165.151749610 g/mol
Monoisotopic Mass 165.151749610 g/mol
Topological Polar Surface Area 23.8 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 186
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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