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587-63-3

587-63-3 structural image
Product Name: Dihydrokawain
Formula: C14H16O3
Synonyms: (6S)-5,6-Dihydro-4-methoxy-6-(2-phenylethyl)-2H-pyran-2-one;7,8-Dihydrokawain;Dihydrokavain;Marindinin
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 2168.1

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 232.27 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 232.109944368 g/mol
Monoisotopic Mass 232.109944368 g/mol
Topological Polar Surface Area 35.5 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 290
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

Dihydrokavain is a member of 2-pyranones and an aromatic ether.