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123-44-4

123-44-4 structural image
Product Name: 2.2.4-TRIMETHYL-1-PENTANOL
Formula: C8H18O
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid; [Aldrich MSDS]
Vapor Pressure 0.49 [mmHg]
Kovats Retention Index 1326 1326
Chemical Classes Solvents -> Alcohols (<C12)

COMPUTED DESCRIPTORS

Molecular Weight 130.23 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 3
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 74.6
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