EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes


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CAS Number: 5273-85-8Picture of molecule3D/inchi
FDA UNII: Search
Nikkaji Web:J8.828E
XlogP3:2.50 (est)
Molecular Weight:208.25712000
Formula:C12 H16 O3
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:natural substances and extractives
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
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:
 water, 155.4 mg/L @ 25 °C (est)
Insoluble in:
Organoleptic Properties:
Odor Type: spicy
spicy floral
Odor Description:at 100.00 %. spicy flower
Odor and/or flavor descriptions from others (if found).
Cosmetic Information:
None found
BOC Sciences
For experimental / research use only.
Isoelemicin >98%
Odor: characteristic
Use: Isoelemicin is a natural phenylpropanoid found in the herbs of Erythrina stricta.
Safety Information:
Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
Safety in Use Information:
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.
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5318557
National Institute of Allergy and Infectious Diseases:Data
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):5318557
Pubchem (sid):135054013
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
KEGG (GenomeNet):C16975
HMDB (The Human Metabolome Database):Search
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
Potential Blenders and core components note
None Found
Potential Uses:
None Found
Occurrence (nature, food, other):note
 centaurea rhizantha
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 cubeb oil @ 0.39%
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 laurel leaf oil turkey @ 0.30%
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 mace oil @ 0.50%
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 piper wallichii
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 salix triandra
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 snake root oil canada @ 0.90%
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1,2,3-trimethoxy-5-(1E)-1-propenyl 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.
None found
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