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18362-97-5

18362-97-5 structural image
Product Name: ISO-PROPYL-VALERATE
Formula: C8H16O2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 924 936 915 915 919 921 915 924

COMPUTED DESCRIPTORS

Molecular Weight 144.21 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 5
Exact Mass 144.115029749 g/mol
Monoisotopic Mass 144.115029749 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 97.4
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

Isopropyl valerate is a natural product found in Globicephala macrorhynchus and Globicephala melas with data available.