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30361-28-5

30361-28-5 structural image
Product Name: (2E,4E)-2,4-Octadienal
Formula: C8H12O
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid; fatty, green, sour aroma
Boiling Point 67.00 °C. @ 0.40 mm Hg
Solubility Insoluble in water; miscible in fats
Density 0.832-0.839
Refractive Index 1.519-1.525
Kovats Retention Index 1086 1086 1087 1090 1088 1088

COMPUTED DESCRIPTORS

Molecular Weight 124.18 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 4
Exact Mass 124.088815002 g/mol
Monoisotopic Mass 124.088815002 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 112
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

(E,E)-2,4-Octadienal is a fatty aldehyde.