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758-86-1

758-86-1 structural image
Product Name: 2,3-DIMETHYL-1,4-PENTADIENE
Formula: C7H12
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 705.6
Chemical Classes Other Classes -> Aliphatics, Unsaturated

COMPUTED DESCRIPTORS

Molecular Weight 96.17 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 2
Exact Mass 96.093900383 g/mol
Monoisotopic Mass 96.093900383 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 7
Formal Charge 0
Complexity 80
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