59677

Supelco

Methyl dihydrojasmonate, mixture of cis and trans

analytical standard

Synonym(s):
(3-Oxo-2-pentylcyclopentyl)acetic acid methyl ester, Methyl (3-oxo-2-pentylcyclopentyl)acetate
Empirical Formula (Hill Notation):
C13H22O3
CAS Number:
Molecular Weight:
226.31
EC Number:
MDL number:
PubChem Substance ID:

grade

analytical standard

Quality Level

assay

≥96.0% (GC)

shelf life

limited shelf life, expiry date on the label

refractive index

n20/D 1.459 (lit.)

bp

110 °C/0.2 mmHg (lit.)

density

0.998 g/mL at 25 °C (lit.)

Featured Industry

Cleaning Products
Cosmetics
Flavors and Fragrances
Food and Beverages
Personal Care

format

neat

SMILES string

CCCCCC1C(CCC1=O)CC(=O)OC

InChI

1S/C13H22O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h10-11H,3-9H2,1-2H3

InChI key

KVWWIYGFBYDJQC-UHFFFAOYSA-N

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General description

Methyl dihydrojasmonates (MDJ) are grouped under the class of cyclopentanones. MDJ is a widely used fragrance ingredient in perfume industries because of its intense floral, jasmine-like odor. Both the trans and cis methyl dihydrojasmonate mixture may be isolated from Jasminum grandiflorum L.

RIDADR

NONH for all modes of transport

WGK Germany

WGK 2

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Evaluation of the developmental toxicity of methyl dihydrojasmonate (MDJ) in rats
Politano VT, et al.
International Journal of Toxicology, 27(3), 295-300 (2008)
Fragrance material review on methyl dihydrojasmonate
Scognamiglio J, et al.
Food And Chemical Toxicology, 50(23), S562-S571 (2012)
Enantioselective synthesis and absolute stereochemistry of both the enantiomers of trans-magnolione, a fragrance structurally related to trans-methyl jasmonate
Donnoli MI, et al.
Tetrahedron, 60(23), 4975-4981 (2004)

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