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

3-(ethyl thio) butanol
(+/-)-3-(ethylthio)butanol

Supplier Sponsors

CAS Number: 117013-33-9Picture of molecule3D/inchi
FDA UNII:408AF93G1U
XlogP3-AA:1.30 (est)
Molecular Weight:134.24178000
Formula:C6 H14 O S
NMR Predictor:Predict (works with chrome or firefox)
Category:flavoring 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:1703 (+/-)-3-(ethylthio)butanol
FEMA Number:4282 (+/-)-3-(ethylthio)butanol
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):117013-33-9 ; (+/-)-3-(ETHYLTHIO)BUTANOL
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 96.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.94100 to 0.94700 @ 25.00 °C.
Pounds per Gallon - (est).: 7.830 to 7.880
Refractive Index:1.46800 to 1.47600 @ 20.00 °C.
Boiling Point: 79.00 to 81.00 °C. @ 1.00 mm Hg
Boiling Point: 154.00 to 155.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.173000 mmHg @ 25.00 °C. (est)
Flash Point: 198.00 °F. TCC ( 92.20 °C. ) (est)
logP (o/w): 1.283 (est)
Soluble in:
 water, 6278 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: cooked
Odor Strength:high ,
recommend smelling in a 0.10 % solution or less
cooked roasted nutty
Odor Description:at 0.10 % in propylene glycol. cooked roasted nutty
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Parchem
3-(ethyl thio) butanol
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
 
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: flavoring agents
Recommendation for 3-(ethyl thio) butanol usage levels up to:
 not for fragrance use.
 
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
 average usual ppmaverage maximum ppm
baked goods: 10.0000050.00000
beverages(nonalcoholic): 1.0000010.00000
beverages(alcoholic): 1.0000010.00000
breakfast cereal: 5.0000010.00000
cheese: 1.0000010.00000
chewing gum: --
condiments / relishes: 2.0000010.00000
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: 2.0000010.00000
hard candy: 10.0000020.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: 3.0000020.00000
milk products: 2.0000010.00000
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: 2.0000010.00000
reconstituted vegetables: --
seasonings / flavors: 5.0000030.00000
snack foods: 5.0000030.00000
soft candy: 2.0000010.00000
soups: 1.0000010.00000
sugar substitutes: --
sweet sauces: --
 
Safety References:
EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :23039305
National Institute of Allergy and Infectious Diseases:Data
3-(ethylsulfanyl)butan-1-ol
Chemidplus:0117013339
 
References:
 3-(ethylsulfanyl)butan-1-ol
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):23039305
Pubchem (sid):135356208
 
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):HMDB32277
FooDB:FDB009409
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
No odor group found for these
sulfuryl octanoate
FL/FR
sulfuryl butyrate
FL/FR
sulfuryl decanoate
FL/FR
sulfuryl hexanoate
FL/FR
sulfuryl isobutyrate
FL/FR
sulfuryl propionate
FL/FR
coffee
coffee
2-
methyl-3-,5 or 6-(furfuryl thio) pyrazine
FL/FR
green
2-
heptyl furan
FL/FR
nutty
2-
acetyl-3-methyl pyrazine
FL/FR
3,6-
cocoa pyrazine
FL/FR
filbert heptenone
FL/FR
nutty quinoxaline
FL/FR
sulfurous
furfuryl thioacetate
FL/FR
For Flavor
No flavor group found for these
3,6-
diethyl-1,2,4,5-tetrathiane and 3,5-diethyl-1,2,4-trithiolane mixture 1% in vegetable oil triglyceri
FL
6,7-
dihydro-2,3-dimethyl-5H-cyclopentapyrazine
FL
dimethyl dihydrocyclopentapyrazine
FL
2,5-
dimethyl thiazole
FL
(Z+E)-5-
ethyl-4-methyl-2-(2-butyl) thiazoline
FL
(Z+E)-5-
ethyl-4-methyl-2-(2-methyl propyl) thiazoline
FL
1-(3-
hydroxy-5-methyl-2-thienyl) ethanone
FL
2-
methyl-3-,5 or 6-(furfuryl thio) pyrazine
FL/FR
1-
phenyl-3(5)-propyl pyrazole
FL
3-iso
propenyl pentane dioic acid
FL
sulfuryl butyrate
FL/FR
sulfuryl decanoate
FL/FR
sulfuryl hexanoate
FL/FR
sulfuryl isobutyrate
FL/FR
thioacetic acid
FL
5-
acetyl-2,3-dihydro-1,4-thiazine
FL
S-
allyl-laevo-cysteine
FL
(±)-3-(
methyl thio) heptanal
FL
3-(
methyl thio) methyl thiophene
FL
2-
methyl-1-methyl thio-2-butene
FL
pyrrolidino-(1,2E)-4H-2,4-dimethyl-1,3,5-dithiazine
FL
sulfuryl formate
FL
sulfuryl octanoate
FL/FR
sulfuryl propionate
FL/FR
fatty
fatty
2-
heptyl furan
FL/FR
fishy
4,5-
dimethyl thiazole
FL
meaty
propyl 2-mercaptopropionate
FL
nutty
2-
acetyl-3-methyl pyrazine
FL/FR
2-
butyl-2-butenal
FL
3,6-
cocoa pyrazine
FL/FR
filbert heptenone
FL/FR
nutty quinoxaline
FL/FR
popcorn
2-
propionyl-2-thiazoline
FL
roasted
furfuryl thioacetate
FL/FR
lactoyl ethanolamine
FL
lactoyl ethanolamine phosphate
FL
sulfurous
2,4,6-
trithiaheptane 10% in triacetin
FL
 
Potential Uses:
FLmeat
FLnut
 
Occurrence (nature, food, other):note
 found in nature
 
Synonyms:
1-butanol, 3-(ethylthio)-
(±)-3-(ethyl thio) butanol
3-(ethylsulfanyl)butan-1-ol
3-(ethylthio) butanol
(+/-)-3-(ethylthio)butanol
(±)-3-(ethylthio)butanol
3-(ethylthio)butanol
3-(ethylthio)butanol, (+/-)-
 

Articles:

 None found yet.
 
Notes:
Used as a food additive [EAFUS]
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