24851-98-7
Product Name:
Methyl dihydrojasmonate
Formula:
C13H22O3
Synonyms:
(3-Oxo-2-pentylcyclopentyl)acetic acid methyl ester;Methyl (3-oxo-2-pentylcyclopentyl)acetate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Dry Powder, Liquid, Other Solid; Liquid; Other Solid |
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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 |
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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 |
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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.