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7779-70-6

7779-70-6 structural image
Product Name: FEMA 2078
Formula: C14H28O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colourless oily liquid with a nutty, oily, apricot-like odour
Boiling Point 260.00 to 261.00 °C. @ 760.00 mm Hg
Solubility Soluble in ethanol, insoluble in water
Density 0.86
Refractive Index 1.427-1.431
Kovats Retention Index 1533 1527

COMPUTED DESCRIPTORS

Molecular Weight 228.37 g/mol
XLogP3 5.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 11
Exact Mass 228.208930132 g/mol
Monoisotopic Mass 228.208930132 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 164
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

PRODUCT INTRODUCTION

description

3-Methylbutyl nonanoate is a fatty acid ester.