hexanal dihexyl acetal
aldehyde C-6 dihexyl acetal
 
Notes:
Used as a food additive [EAFUS]
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      Product(s):
      33673-65-3 1,1-bis-(Hexyloxy)hexane
       
  • CSA
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CAS Number: 33673-65-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 251-631-5
FDA UNII: 89PUE1O508
Nikkaji Web: J260.957F
XlogP3-AA: 7.10 (est)
Molecular Weight: 286.49926000
Formula: C18 H38 O2
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
JECFA Food Flavoring: 1738  hexanal dihexyl acetal
FEMA Number: 4370 hexanal dihexyl acetal
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):33673-65-3 ; HEXANAL DIHEXYL ACETAL
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.83800 to 0.84400 @  25.00 °C.
Pounds per Gallon - (est).: 6.973 to  7.023
Refractive Index: 1.43100 to 1.43600 @  20.00 °C.
Boiling Point: 264.00 to  265.00 °C. @ 760.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure: 0.016000 mmHg @ 25.00 °C. (est)
Flash Point: 121.00 °F. TCC ( 49.44 °C. )
logP (o/w): 7.136 (est)
Soluble in:
 alcohol
 water, 0.01275 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: green
 
Odor Strength: medium
 
 green  grassy  
Odor Description:
at 100.00 %. 
mild green grassy
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Aston Chemical
For experimental / research use only.
Hexane,1,1-bis(hexyloxy)-
Axsyn
For experimental / research use only.
Hexane,1,1-bis(hexyloxy)-
BOC Sciences
For experimental / research use only.
1,1-bis-(Hexyloxy)hexane
Inoue Perfumery
HEXANAL DIHEXYL ACETAL
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the CSA
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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: flavor and fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for hexanal dihexyl acetal usage levels up to:
  6.0000 % in the fragrance concentrate.
 
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 23
Click here to view publication 23
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): 1.0000010.00000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: 5.0000030.00000
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: 0.500003.00000
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 2.0000010.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
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Safety References:
EPI System: View
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 118530
National Institute of Allergy and Infectious Diseases: Data
 1,1-dihexoxyhexane
Chemidplus: 0033673653
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References:
 1,1-dihexoxyhexane
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 33673-65-3
Pubchem (cid): 118530
Pubchem (sid): 135075253
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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
FDA Substances Added to Food (formerly EAFUS): View
HMDB (The Human Metabolome Database): HMDB32316
FooDB: FDB009564
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
alliaceous
alliaceous
 dibutyl sulfideFL/FR
citrus
 litsea cubeba fruit oilFL/FR
floral
 mimosa absolute franceFL/FR
fruity
2-methyl-2-pentenalFL/FR
green
 bark carbaldehydeFR
 butyl heptanoateFL/FR
sec-butyl-3-methyl but-2-ene thioateFL/FR
3,7-dimethyl-6-octenoic acidFL/FR
(Z)-3-hepten-1-olFL/FR
3-hepten-2-oneFL/FR
 heptyl heptanoateFL/FR
(Z)-3-hexenalFL/FR
 lilac acetaldehydeFL/FR
 propylene acetalFL/FR
3,5,5-trimethyl hexanolFL/FR
spicy
3-(2-furyl) acroleinFL/FR
 
For Flavor
 
No flavor group found for these
 ascorbic acidFL
sec-butyl-3-methyl but-2-ene thioateFL/FR
2-ethyl pyridineFL
3-(2-furyl) acroleinFL/FR
(Z)-3-hepten-1-olFL/FR
2-heptenoic acidFL
(Z)-3-hexenoic acidFL
3-(methyl thio) hexanalFL
(E,E)-3,5-octadien-2-oneFL
 propylene acetalFL/FR
citrus
 litsea cubeba fruit oilFL/FR
creamy
3-hepten-2-oneFL/FR
floral
3,7-dimethyl-6-octenoic acidFL/FR
fruity
 butyl heptanoateFL/FR
 lilac acetaldehydeFL/FR
2-methyl-2-pentenalFL/FR
green
 dibutyl sulfideFL/FR
 heptyl heptanoateFL/FR
(Z)-3-hexenalFL/FR
3,5,5-trimethyl hexanolFL/FR
waxy
 mimosa absolute franceFL/FR
 
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Potential Uses:
 fruitFR
 grass 
 greenFL
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 aldehyde C-6 dihexyl acetal
1,1-dihexoxyhexane
 hexane, 1,1-bis(hexyloxy)-
 hexane,1,1-bis(hexyloxy)-
1,1-bis(hexyl oxy) hexane
1,1-bis(hexyloxy)hexane
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