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4850-28-6

4850-28-6 structural image
Product Name: CIS,CIS,TRANS-1,2,4-TRIMETHYLCYCLOPENTANE
Formula: C8H16
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 772.1 768.75 797 753.9 769 768
Chemical Classes Solvents -> Aliphatics, Saturated (<C12)

COMPUTED DESCRIPTORS

Molecular Weight 112.21 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 0
Exact Mass 112.125200510 g/mol
Monoisotopic Mass 112.125200510 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 66.1
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes