allyl isononylate
allyl trimethylhexoate
 
Notes:
None found
  • Charkit Chemical
    • Charkit Chemical Corporation
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      Since 1982, Charkit has been committed to expanding the markets we serve as our roster of products and services continues to grow with us. Our substantial portfolio of personal care ingredients now include a wide array of luxury and exotic components to compliment the key products we have always offered. We have expanded our offerings to the nutraceutical, industrial, and resin markets with a growing roster of versatile and unique ingredients. We continue to lead the way in our traditional markets such as Metal and Water Treatment, Imaging, Flavor & Fragrance, Aroma and Food. Our Pharmaceutical offerings continue to expand, still anchored by the Boronic Derivatives that meet the demands of Suzuki coupling reactions. Please contact us to learn how we can help you reach your goals.
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      Product(s):
      ALLYL 3,5,5-TRIMETHYLHEXANOATE 1NCA0400
       
  • Penta International
    • Penta International Corporation
      Chemistry innovation
      At Penta, our products and services help businesses do business better.
      For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes.
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      Product(s):
      01-22000 ALLYL TRIMETHYL HEXANOATE, Kosher
       
Synonyms   Articles   Notes   Search
prop-2-enyl 5,5-dimethylheptanoate (Click)
CAS Number: 68132-80-9Picture of molecule
ECHA EINECS - REACH Pre-Reg: 268-648-9
XlogP3-AA: 3.90 (est)
Molecular Weight: 198.30574000
Formula: C12 H22 O2
NMR Predictor: Predict (works with chrome or firefox)
Category: 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
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 98.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.86900 to 0.87600 @  20.00 °C.
Pounds per Gallon - (est).: 7.239 to  7.298
Refractive Index: 1.42900 to 1.43300 @  20.00 °C.
Boiling Point: 208.00 to  210.00 °C. @ 760.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure: 0.032000 mm/Hg @ 25.00 °C. (est)
Flash Point: 181.00 °F. TCC ( 82.78 °C. )
logP (o/w): 4.402 (est)
Soluble in:
 alcohol
 water, 5.859 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items: note
allyl nonylate
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Organoleptic Properties:
 
Odor Type: fruity
 
Odor Strength: medium
 
 fruity  rose  sweet  musk  
Odor Description:
at 100.00 %. 
fruity rose sweet musk
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
Charkit Chemical
ALLYL 3,5,5-TRIMETHYLHEXANOATE 1NCA0400
Penta International
ALLYL TRIMETHYL HEXANOATE, Kosher
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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: fragrance agents
IFRA Purity Specification: < 0.1% free allyl alcohol
IFRA: View Standard
Recommendation for allyl isononylate usage levels up to:
  5.0000 % in the fragrance concentrate.
 
Recommendation for allyl isononylate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
EPA Substance Registry Services (TSCA): 68132-80-9
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 109507
National Institute of Allergy and Infectious Diseases: Data
SCCNFP: opinion
 prop-2-enyl 5,5-dimethylheptanoate
Chemidplus: 0068132809
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References:
 prop-2-enyl 5,5-dimethylheptanoate
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 109507
Pubchem (sid): 135065334
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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
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
amber
 ambrette seed absoluteFL/FR
aromatic
 damascone carboxylateFR
floral
 benzyl isobutyrateFL/FR
 cassis buteneoneFR
 citronellal diisotridecyl acetalFR
 citronellyl acetateFL/FR
(S)-citronellyl acetateFL/FR
 citronellyl anthranilateFL/FR
 citronellyl hexanoateFL/FR
 citronellyl propionateFL/FR
(E)-citronellyl tiglateFL/FR
3-cyclohexene-1-carboxylic acid, 2,6,6-trimethyl-, methyl esterFR
beta-damascenoneFL/FR
delta-damasconeFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 ethyl linalyl acetateFR
 ethyl ortho-anisateFL/FR
 eucalyptus macarthurii oilFR
 geraniolFL/FR
 geranium oil egypt fractionsFR
 geranyl formateFL/FR
 geranyl isobutyrateFL/FR
 geranyl phenyl acetateFL/FR
 geranyl propionateFL/FR
 geranyl valerateFL/FR
 musk acetateFR
 phenethyl isobutyrateFL/FR
 phenethyl isovalerateFL/FR
 phenethyl propionateFL/FR
2-phenethyl valerateFL/FR
3-phenyl propionic acidFL/FR
 rhodinyl butyrateFL/FR
 rose butanoateFL/FR
 styralyl propionateFL/FR
fresh
10-undecen-1-yl acetateFL/FR
fruity
(E)-ethyl tiglateFL/FR
(E,Z)-6-ethyl-5,7-dimethyl-2,5-octadien-4-oneFR
 geranyl butyrateFL/FR
 octyl formateFL/FR
(E,E)-pomaroseFR
 thesaron (Takasago)FR
green
 hexyl phenyl acetateFL/FR
herbal
 geranium cyclohexaneFR
 geranyl octanoateFL/FR
 linalyl formateFL/FR
musk
 musk indaneFR
 musk nonaneFR
 musk tetralinFR
waxy
 dihydrocitronellyl acetateFL/FR
 ethyl nonanoateFL/FR
winey
 butyl angelateFL/FR
woody
 labdanum ethanoneFR
 santalyl butyrateFL/FR
 
For Flavor
 
No flavor group found for these
 butyl angelateFL/FR
 dihydrocitronellyl acetateFL/FR
 ethyl ortho-anisateFL/FR
 geranyl octanoateFL/FR
 geranyl valerateFL/FR
 linalyl formateFL/FR
2-phenethyl valerateFL/FR
3-phenyl propionic acidFL/FR
 santalyl butyrateFL/FR
citrus
 styralyl propionateFL/FR
floral
(S)-citronellyl acetateFL/FR
 citronellyl acetateFL/FR
 citronellyl hexanoateFL/FR
 citronellyl propionateFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 geraniolFL/FR
 geranyl isobutyrateFL/FR
 geranyl phenyl acetateFL/FR
 phenethyl propionateFL/FR
 rhodinyl butyrateFL/FR
fruity
 benzyl isobutyrateFL/FR
 citronellyl anthranilateFL/FR
(E)-ethyl tiglateFL/FR
 geranyl butyrateFL/FR
 hexyl phenyl acetateFL/FR
 phenethyl isovalerateFL/FR
 rose butanoateFL/FR
greasy
10-undecen-1-yl acetateFL/FR
green
(E)-citronellyl tiglateFL/FR
 geranyl formateFL/FR
 octyl formateFL/FR
honey
 phenethyl isobutyrateFL/FR
waxy
 ethyl nonanoateFL/FR
 geranyl propionateFL/FR
woody
 ambrette seed absoluteFL/FR
beta-damascenoneFL/FR
delta-damasconeFL/FR
 
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Potential Uses:
 floralFR
 fruitFR
 roseFR
 tropical 
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 allyl isononylate
 allyl trimethyl hexanoate
5,5-allyl trimethyl hexanoate
 allyl trimethylhexoate
 hexanoic acid, methyl-, 2-propen-1-yl ester
 hexanoic acid, trimethyl-, 2-propenyl ester
 prop-2-en-1-yl 5,5-dimethylheptanoate
 prop-2-enyl 5,5-dimethyl heptanoate
 prop-2-enyl 5,5-dimethylheptanoate
2-propenyl 5,5-dimethyl heptanoate
2-propenyl trimethyl hexanoate
 trimethyl hexanoic acid 2-propenyl ester
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Articles:
 None found yet.
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