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7319-23-5

7319-23-5 structural image
Product Name: 3-HEXENE-2,5-DIOL
Formula: C6H12O2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1932 1932 1940

COMPUTED DESCRIPTORS

Molecular Weight 116.16 g/mol
XLogP3 0
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 116.083729621 g/mol
Monoisotopic Mass 116.083729621 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 68.6
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes