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129415-93-6

129415-93-6 structural image
Product Name: 4-HYDROXY-3,3-DIMETHYLBUTYRONITRILE
Formula: C6H10BrN
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COMPUTED DESCRIPTORS

Molecular Weight 176.05 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 2
Exact Mass 174.99966 g/mol
Monoisotopic Mass 174.99966 g/mol
Topological Polar Surface Area 23.8 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 109
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
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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