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para-anisyl hexanoate
4-methoxybenzyl hexanoate

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Name:(4-methoxyphenyl)methyl hexanoate
CAS Number: 6624-60-8Picture of molecule3D/inchi
Nikkaji Web:J155.599E
XlogP3-AA:3.50 (est)
Molecular Weight:236.31100000
Formula:C14 H20 O3
NMR Predictor:Predict (works with chrome or firefox)
Category:flavor and fragrance agents
 
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
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 96.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 319.00 to 320.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.000330 mm/Hg @ 25.00 °C. (est)
Flash Point: 268.00 °F. TCC ( 131.11 °C. )
logP (o/w): 3.925 (est)
Soluble in:
 alcohol
 water, 8.421 mg/L @ 25 °C (est)
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Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
M&U International
Nat. Anisyl Caproate
 
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
 
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for para-anisyl hexanoate usage levels up to:
  3.0000 % in the fragrance concentrate.
 
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):6624-60-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :81102
National Institute of Allergy and Infectious Diseases:Data
(4-methoxyphenyl)methyl hexanoate
Chemidplus:0006624608
 
References:
 (4-methoxyphenyl)methyl hexanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):81102
Pubchem (sid):135038717
Pherobase:View
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 anise seed oil colombia @ trace%
Data GC Search Trop Picture
 heracleum paphlagonicum czeczott fruit oil turkey @ <0.10%
Data GC Search Trop Picture
 
Synonyms:
 anisyl caproate
p-anisyl hexanoate
 hexanoic acid (4-methoxyphenyl) methyl ester
 hexanoic acid, (4-methoxyphenyl)methyl ester
4-methoxybenzyl hexanoate
(4-methoxyphenyl)methyl hexanoate
 

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Notes:
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