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54630-50-1

54630-50-1 structural image
Product Name: 5-METHYL-2-HEPTANOL
Formula: C8H18O
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 856

COMPUTED DESCRIPTORS

Molecular Weight 130.23 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 4
Exact Mass 130.135765193 g/mol
Monoisotopic Mass 130.135765193 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 61.6
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes