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6321-45-5

6321-45-5 structural image
Product Name: ALLYL N-VALERATE
Formula: C8H14O2
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CHEMICAL AND PHYSICAL PROPERTIES

Boiling Point 164.00 to 165.00 °C. @ 760.00 mm Hg
Kovats Retention Index 960 965

COMPUTED DESCRIPTORS

Molecular Weight 142.20 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 6
Exact Mass 142.099379685 g/mol
Monoisotopic Mass 142.099379685 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 108
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

Allyl valerate is a fatty acid ester.