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24851-98-7

24851-98-7 structural image
Product Name: Methyl dihydrojasmonate
Formula: C13H22O3
Synonyms: (3-Oxo-2-pentylcyclopentyl)acetic acid methyl ester;Methyl (3-oxo-2-pentylcyclopentyl)acetate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Dry Powder, Liquid, Other Solid; Liquid; Other Solid
Solubility Soluble in oils; very slightly soluble in water
Density 0.997-1.008 (20°)
Refractive Index 1.454-1.464
Kovats Retention Index 1648 1649 1650

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 226.31 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 7
Exact Mass 226.15689456 g/mol
Monoisotopic Mass 226.15689456 g/mol
Topological Polar Surface Area 43.4 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 248
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Methyl 2-(3-oxo-2-pentylcyclopentyl)acetate is a lipid. It is functionally related to a jasmonic acid.