(E)-isoelemicin

1,2,3-trimethoxy-5-(1E)-1-propenylbenzene

CAS: 5273-85-8 C12 H16 O3 MW: 208.25712000 spicy

Identification

Name	(E)-isoelemicin
IUPAC	1,2,3-trimethoxy-5-[(E)-prop-1-enyl]benzene
CAS Number	5273-85-8
FDA UNII	Search
Molecular Formula	C12 H16 O3
Molecular Weight	208.25712000
Nikkaji Number	J8.828E
XlogP3	2.50 (est)

Regulatory

Physical Properties

Assay	95.00 to 100.00
Food Chemicals Codex Listed	No
Boiling Point	306.00 to 307.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure	0.001000 mmHg @ 25.00 °C. (est)
Flash Point	216.00 °F. TCC ( 102.20 °C. ) (est)
logP (o/w)	2.792 (est)
Soluble in	alcohol
Insoluble in	water

Organoleptic Properties

Odor Description

at 100.00 %.

Safety Information

Oral/Parenteral Toxicity	Not determined
Dermal Toxicity	Not determined
Inhalation Toxicity	Not determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Category	natural substances and extractives
Recommendation for (E)-isoelemicin usage levels up to	not for fragrance use.
Recommendation for (E)-isoelemicin flavor usage levels up to	not for flavor use.

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5273-85-8 Isoelemicin >98%

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Potential Uses

None Found

Natural Occurrence

centaurea rhizantha cubeb oil @ 0.39% Data laurel leaf oil turkey @ 0.30% Data mace oil @ 0.50% Data piper wallichii salix triandra snake root oil canada @ 0.90% Data

Synonyms

trans-iso elemicin 1,2,3- trimethoxy-5-(1E)-1-propenyl benzene 1,2,3- trimethoxy-5-(1E)-1-propenylbenzene 1,2,3- trimethoxy-5-[(E)-prop-1-enyl]benzene PubMed: GC/GC-MS analysis, isolation and identification of bioactive essential oil components from the Bhutanese medicinal plant, Pleurospermum amabile. PubMed: Chemical composition and antimicrobial activity of Phyllanthus muellerianus (Kuntze) Excel essential oil. PubMed: Secondary metabolites from the phloem of Piper solmsianum (Piperaceae) in the honeydew of Edessa meditabunda. PubMed: Isolation of bioactive compounds that relate to the anti-platelet activity of Cymbopogon ambiguus. PubMed: Isolation of antifungal and larvicidal constituents of Diplolophium buchanani by centrifugal partition chromatography.