coniferyl benzoate
(2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propen-1-yl benzoate
 
Notes:
None found
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CAS Number: 4159-29-9Picture of molecule3D/inchi
XlogP3-AA: 3.50 (est)
Molecular Weight: 284.31132000
Formula: C17 H16 O4
NMR Predictor: Predict (works with chrome or firefox)
Category: natural substances and extractives
 
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 65.00 to  75.00 °C. @ 12.00 mm Hg
Boiling Point: 471.00 °C. @ 760.00 mm Hg (est)
Flash Point: 344.00 °F. TCC ( 173.50 °C. ) (est)
logP (o/w): 4.171 (est)
Soluble in:
 alcohol
 water, 11.61 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
 None found
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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
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: natural substances and extractives
Recommendation for coniferyl benzoate usage levels up to:
 not for fragrance use.
 
Recommendation for coniferyl benzoate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
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EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 6441293
National Institute of Allergy and Infectious Diseases: Data
 [(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl] benzoate
Chemidplus: 0004159299
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References:
 [(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl] benzoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 4159-29-9
Pubchem (cid): 6441293
Pubchem (sid): 135121059
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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
CHEBI: View
Metabolomics Database: Search
HMDB (The Human Metabolome Database): Search
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 benzoin gum
Search  PMC Picture
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Synonyms:
4-(3-(benzoyl oxy)-1-propenyl)-2-methoxyphenol
4-(3-(benzoyloxy)-1-propenyl)-2-methoxyphenol
(2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propen-1-yl benzoate
(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-yl benzoate
[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl] benzoate
 phenol, 4-[(1E)-3-(benzoyloxy)-1-propen-1-yl]-2-methoxy-
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Articles:
PubMed: Analytical investigation of styrax and benzoin balsams by HPLC- PAD-fluorimetry and GC-MS.
PubMed: Contact allergy to balsam of Peru. II. Patch test results in 102 patients with selected balsam of Peru constituents.
PubMed: Physiological and behavioral effects of coniferyl benzoate on avian reproduction.
PubMed: Propolis allergy (IV). Studies with further sensitizers from propolis and constituents common to propolis, poplar buds and balsam of Peru.
PubMed: Role of avian trigeminal sensory system in detecting coniferyl benzoate, a plant allelochemical.
PubMed: Coniferyl benzoate in quaking aspen A ruffed grouse feeding deterrent.
PubMed: Ruffed grouse feeding behavior and its relationship to secondary metabolites of quaking aspen flower buds.
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