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69830-92-8

69830-92-8 structural image
Product Name: (S)-4-DODECANOLIDE STANDARD FOR GC
Formula: C12H22O2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1680

COMPUTED DESCRIPTORS

Molecular Weight 198.30 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 7
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 166
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
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

Gamma-dodecalactone is a gamma-lactone that is oxolan-2-one substituted by an octyl group at position 5. It has a role as a fungal metabolite, a volatile oil component and a bacterial metabolite.