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

vanillyl butyl ether
butyl vanillyl ether

Supplier Sponsors

Name:4-(butoxymethyl)-2-methoxyphenol
CAS Number: 82654-98-6Picture of molecule3D/inchi
FDA UNII:S2ULN37C9R
Nikkaji Web:J60.915C
MDL:MFCD00238529
XlogP3:1.80 (est)
Molecular Weight:210.27306000
Formula:C12 H18 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
JECFA Food Flavoring:888 vanillyl butyl ether
FLAVIS Number:04.093 (Old)
DG SANTE Food Flavourings:04.093 butyl vanillyl ether
FEMA Number:3796 vanillyl butyl ether
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):82654-98-6 ; VANILLYL BUTYL ETHER
 
Physical Properties:
Appearance:colorless to pale yellow clear viscous liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.04800 to 1.06800 @ 25.00 °C.
Pounds per Gallon - (est).: 8.720 to 8.887
Refractive Index:1.51100 to 1.52100 @ 20.00 °C.
Boiling Point: 241.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.000388 mmHg @ 25.00 °C. (est)
Flash Point:> 230.00 °F. TCC ( > 110.00 °C. )
logP (o/w): 2.590 (est)
Soluble in:
 alcohol
 water, 236.4 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor Type: vanilla
Odor Strength:medium
vanilla fruity
Odor Description:at 100.00 %. vanilla fruity
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: hair conditioning
masking agents
oral care agents
skin conditioning
 
Suppliers:
Beijing Lys Chemicals
Vanillyl butyl ether
BOC Sciences
For experimental / research use only.
Vanillyl Butyl Ether
DeLong Chemicals America
Vanillyl Butyl Ether
Jiangyin Healthway
Vanillyl Butyl Ether
New functional food ingredients
Lipo Chemicals
Hotact® VBE
Odor: characteristic
Use: Hotact® VBE is a unique sensory agent that provides a warming effect to the skin. The effect of Hotact® VBE can be felt immediately upon application, building rapidly within the first five minutes and lasting up to two hours. Structurally similar to natural warming agents, it is less irritating than capsaicin or capsicum extract.
Penta International
VANILLYL BUTYL ETHER NATURAL
Penta International
VANILLYL BUTYL ETHER
Santa Cruz Biotechnology
For experimental / research use only.
Vanillyl Butyl Ether
Shijiazhuang Donglian Nankai Aroma Chemicals
Vanillyl Butyl Ether
Odor: characteristic
Use: mainly used for cosmetic industry
Sigma-Aldrich
Vanillyl butyl ether, ≥96%, FG
Certified Food Grade Products
Sigma-Aldrich
Vanillyl butyl ether, natural (US), 97%, FG
Odor: vanilla
Soda Aromatic
Vanillyl Butyl Ether
Synerzine
Vanillyl Butyl Ether
Tianjin Danjun International
Vanillyl butyl ether
United International
Vanillyl Butyl Ether
WholeChem
Vanillyl butyl ether
 
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
 
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:
gavage-rat LD50 [sex: M,F] M:5104 F:4734 mg/kg
(Buch, 1989)

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for vanillyl butyl ether usage levels up to:
  5.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 1.40 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.10 (μg/capita/day)
Structure Class: II
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: 16. Update in publication number(s): 19, 25
Click here to view publication 16
 average usual ppmaverage maximum ppm
baked goods: 5.0000020.00000
beverages(nonalcoholic): 8.0000020.00000
beverages(alcoholic): 30.0000080.00000
breakfast cereal: 60.00000100.00000
cheese: 100.00000200.00000
chewing gum: 3500.000004200.00000
condiments / relishes: 40.0000075.00000
confectionery froastings: 70.00000100.00000
egg products: 5.0000010.00000
fats / oils: 200.00000300.00000
fish products: 200.00000250.00000
frozen dairy: 100.00000150.00000
fruit ices: 35.0000050.00000
gelatins / puddings: 70.00000100.00000
granulated sugar: 50.00000100.00000
gravies: 10.0000020.00000
hard candy: 400.00000700.00000
imitation dairy: 90.00000110.00000
instant coffee / tea: 15.0000030.00000
jams / jellies: 35.0000050.00000
meat products: 10.0000020.00000
milk products: 25.0000050.00000
nut products: 200.00000500.00000
other grains: 60.00000100.00000
poultry: 100.00000250.00000
processed fruits: 5.0000025.00000
processed vegetables: 5.0000025.00000
reconstituted vegetables: 5.0000010.00000
seasonings / flavors: 10.0000020.00000
snack foods: 25.0000065.00000
soft candy: 400.00000500.00000
soups: 30.0000045.00000
sugar substitutes: 40.0000055.00000
sweet sauces: 65.0000080.00000
 
Safety References:
European Food Safety Athority(efsa):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...

European Food Safety Authority (EFSA) reference(s):

Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) on a request from the Commission related to Flavouring Group Evaluation 20 (FGE.20): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical group 23
View page or View pdf

Flavouring Group Evaluation 52 (FGE.52): Consideration of hydroxy- and alkoxy-substituted benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters evaluated by EFSA in FGE.20 (2005) (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
View page or View pdf

Flavouring Group Evaluation 54 (FGE.54)[1] - Consideration of benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters evaluated by EFSA in FGE.20 (2005) - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food
View page or View pdf

Flavouring Group Evaluation 20, Revision 1 (FGE.20Rev1): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters from chemical group 23
View page or View pdf

Flavouring Group Evaluation 54, Revision 1 (FGE.54Rev1): Consideration of benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters evaluated by EFSA in FGE.20Rev1 (2009)
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 20, Revision 2 (FGE.20Rev2): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical groups 23 and 30
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 20, Revision 3(FGE.20Rev3): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical groups 23 and 30
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 96 (FGE.96): Consideration of 88 flavouring substances considered by EFSA for which EU production volumes / anticipated production volumes have been submitted on request by DG SANCO. Addendum to FGE. 51, 52, 53, 54, 56, 58, 61, 62, 63, 64, 68, 69, 70, 71, 73, 76, 77, 79, 80, 83, 84, 85 and 87.
View page or View pdf

EPI System: View
EPA Substance Registry Services (TSCA):82654-98-6
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5084146
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
4-(butoxymethyl)-2-methoxyphenol
Chemidplus:0082654986
 
References:
 4-(butoxymethyl)-2-methoxyphenol
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:82654-98-6
Pubchem (cid):5084146
Pubchem (sid):135288541
 
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
FDA Substances Added to Food (formerly EAFUS):View
HMDB (The Human Metabolome Database):HMDB37642
FooDB:FDB016758
ChemSpider:View
 
Potential Blenders and core components note
For Odor
anisic
para-
acetanisole
FL/FR
ortho-
anisaldehyde
FL/FR
balsamic
benzoin
FL/FR
sumatra
benzoin absolute
FL/FR
siam
benzoin absolute
FL/FR
sumatra
benzoin resin
FL/FR
siam
benzoin resin
FL/FR
siam
benzoin resinoid
FL/FR
sumatra
benzoin resinoid
FL/FR
1-
benzoyl acetone
FL/FR
peru balsam oil
FL/FR
peru balsam resinoid
FL/FR
chocolate
vanillyl ethyl ether
FL/FR
coumarinic
coumane
FL/FR
creamy
para-
vanillic acid
FL/FR
para-
vanillyl alcohol
FL/FR
veratraldehyde
FL/FR
fermented
valeraldehyde
FL/FR
floral
para-
cresyl laurate
FL/FR
heliotropin
FL/FR
fruity
vanilla carboxylate
FL/FR
minty
menthoxypropane diol
FL/FR
vanillin menthoxypropane diol acetal
FL/FR
naphthyl
2,4-
dimethyl benzaldehyde
FL/FR
nutty
resorcinol
FR
phenolic
ethyl vanillate
FL/FR
ortho-
guaiacol
FL/FR
powdery
para-
anisyl acetate
FL/FR
smoky
alpha-
ethoxy-ortho-cresol
FL/FR
spicy
para-
anisyl formate
FL/FR
dianthus ethone
FR
(E)-para-
methoxycinnamaldehyde
FL/FR
para-
methoxycinnamaldehyde
FL/FR
4-
methyl guaiacol
FL/FR
zingerone
FL/FR
sweet
vanilla oleoresin bali
FL/FR
vanilla resinoid
FL/FR
tonka
coumarin
FR
vanilla
acetovanillone
FL/FR
ortho-
dimethyl hydroquinone
FL/FR
ethyl vanillin
FL/FR
ethyl vanillin hexylene glycol acetal
FR
ethyl vanillin isobutyrate
FL/FR
ethyl vanillin propylene glycol acetal
FL/FR
heliotropyl alcohol
FL/FR
methyl vanillate
FL/FR
propenyl guaethol
FL/FR
vanilla bean absolute (vanilla planifolia)
FL/FR
vanilla cresol
FR
vanillin
FL/FR
vanillin 2,3-butylene glycol acetal
FL/FR
vanillin hexylene glycol acetal
FR
vanillin propylene glycol acetal
FL/FR
vanillyl acetate
FL/FR
vanillyl isobutyrate
FL/FR
vanillylidene acetone
FL/FR
woody
guaiacyl acetate
FL/FR
For Flavor
No flavor group found for these
benzoin
FL/FR
1-
benzoyl acetone
FL/FR
coumane
FL/FR
ortho-
dimethyl hydroquinone
FL/FR
alpha-
ethoxy-ortho-cresol
FL/FR
glucoethyl vanillin
FL
heliotropyl alcohol
FL/FR
menthoxypropane diol
FL/FR
(E)-para-
methoxycinnamaldehyde
FL/FR
4-
methoxysalicylaldehyde
FL
methyl vanillate
FL/FR
vanillin menthoxypropane diol acetal
FL/FR
anisic
anisic
para-
acetanisole
FL/FR
ortho-
anisaldehyde
FL/FR
balsamic
sumatra
benzoin resin
FL/FR
siam
benzoin resin
FL/FR
siam
benzoin resinoid
FL/FR
sumatra
benzoin resinoid
FL/FR
peru balsam
FL
peru balsam oil
FL/FR
peru balsam resinoid
FL/FR
vanillylidene acetone
FL/FR
cherry
heliotropin
FL/FR
para-
methoxycinnamaldehyde
FL/FR
coconut
6-
methyl coumarin
FL
creamy
divanillin
FL
ethyl vanillate
FL/FR
para-
vanillic acid
FL/FR
para-
vanillyl alcohol
FL/FR
veratraldehyde
FL/FR
fruity
para-
anisyl acetate
FL/FR
vanilla carboxylate
FL/FR
naphthyl
2,4-
dimethyl benzaldehyde
FL/FR
nutty
furfural acetone
FL
powdery
powdery ketone
FL
rummy
vanillyl ethyl ether
FL/FR
spicy
para-
anisyl formate
FL/FR
siam
benzoin absolute
FL/FR
sumatra
benzoin absolute
FL/FR
zingerone
FL/FR
sweet
vanilla oleoresin bali
FL/FR
vanilla resinoid
FL/FR
vanilla
acetovanillone
FL/FR
ethyl vanillin
FL/FR
ethyl vanillin isobutyrate
FL/FR
ethyl vanillin propylene glycol acetal
FL/FR
4-
methyl guaiacol
FL/FR
propenyl guaethol
FL/FR
vanilla bean absolute (vanilla planifolia)
FL/FR
vanillin
FL/FR
vanillin 2,3-butylene glycol acetal
FL/FR
vanillin propylene glycol acetal
FL/FR
vanillyl acetate
FL/FR
vanillyl isobutyrate
FL/FR
waxy
para-
cresyl laurate
FL/FR
winey
valeraldehyde
FL/FR
woody
ortho-
guaiacol
FL/FR
guaiacyl acetate
FL/FR
 
Potential Uses:
FRvanilla
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
4-butoxy-2-methoxyphenol
4-(butoxymethyl)-2-methoxyphenol
 butyl vanillyl ether
 phenol, 4-(butoxymethyl)-2-methoxy-
 vanillylbutylether
 

Articles:

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Notes:
Cooling agent used in confectionery etc.
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