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56797-44-5

56797-44-5 structural image
Product Name: 8,11,14-Heptadecatrienal, (8Z,11Z,14Z)-
Formula: C17H28O
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1874 1852 1864

COMPUTED DESCRIPTORS

Molecular Weight 248.4 g/mol
XLogP3 5.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 12
Exact Mass 248.214015512 g/mol
Monoisotopic Mass 248.214015512 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 248
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 3
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

(8Z,11Z,14Z)-heptadecatrienal is a polyunsaturated fatty aldehyde that is heptadecenal having three double bonds located at postions 8, 11 and 14 (the 8Z,11Z,14Z-geoisomer). It has a role as a metabolite.