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42903-71-9

42903-71-9 structural image
Product Name: N-HEPTANE-1,1,1-D3
Formula: C7H13D3
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 697.76

COMPUTED DESCRIPTORS

Molecular Weight 103.22 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 4
Exact Mass 103.144030748 g/mol
Monoisotopic Mass 103.144030748 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 7
Formal Charge 0
Complexity 19.2
Isotope Atom Count 3
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