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36118-45-3

36118-45-3 structural image
Product Name: pyrazoline
Formula: C3H6N2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 771

COMPUTED DESCRIPTORS

Molecular Weight 70.09 g/mol
XLogP3 -0.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 70.053098200 g/mol
Monoisotopic Mass 70.053098200 g/mol
Topological Polar Surface Area 24.4 Ų
Heavy Atom Count 5
Formal Charge 0
Complexity 48.9
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