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84642-60-4

84642-60-4 structural image
Product Name: FEMA 3517
Formula: C12H22O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colourless liquid; Fruity aroma
Solubility Soluble in fats; Insoluble in water
Density 0.890-0.896
Refractive Index 1.433-1.439

COMPUTED DESCRIPTORS

Molecular Weight 198.30 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 9
Exact Mass 198.161979940 g/mol
Monoisotopic Mass 198.161979940 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 162
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

(E)-2-Octenyl butyrate is a carboxylic ester.