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

methyl furfuryl mercaptopropionate
methyl 3-(furfurylthio)propionate

Supplier Sponsors

Name:methyl 3-(2-furylmethylsulfanyl)propanoate
CAS Number: 94278-26-9Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:304-715-1
FDA UNII:L1387H8Y3U
Nikkaji Web:J326.390H
MDL:MFCD00053109
XlogP3-AA:1.30 (est)
Molecular Weight:200.25724000
Formula:C9 H12 O3 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
PubMed:Search
NCBI:Search
JECFA Food Flavoring:2094 methyl 3-(furfurylthio)propionate
FLAVIS Number:13.143 (Old)
DG SANTE Food Flavourings:13.143 methyl 3-(furfurylthio)propionate
FEMA Number:4538 methyl 3-(furfurylthio)propionate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):94278-26-9 ; METHYL 3-(FURFURYLTHIO)PROPIONATE
 
Physical Properties:
Appearance:pale yellow to amber clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.16000 to 1.18000 @ 25.00 °C.
Pounds per Gallon - (est).: 9.652 to 9.819
Specific Gravity:1.16700 to 1.17300 @ 20.00 °C.
Pounds per Gallon - est.: 9.722 to 9.772
Refractive Index:1.50900 to 1.51900 @ 20.00 °C.
Boiling Point: 113.00 to 116.00 °C. @ 0.20 mm Hg
Boiling Point: 338.00 to 339.00 °C. @ 760.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure:0.003000 mmHg @ 25.00 °C. (est)
Vapor Density:6.8 ( Air = 1 )
Flash Point: 197.00 °F. TCC ( 91.67 °C. )
logP (o/w): 1.971 (est)
Soluble in:
 alcohol
 water, 808.3 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: earthy
Odor Strength:high ,
recommend smelling in a 0.10 % solution or less
earthy fruity sweet
Odor Description:at 0.10 % in propylene glycol. earthy fruity sweet
Flavor Type: coffee
coffee meaty nutty
Taste Description: coffee meaty nutty
Odor and/or flavor descriptions from others (if found).
Frutarom
METHYL FURFURYLMERCAPTOPROPIONATE
Odor Description:Earthy, Fruity, Sweet
Suggested Uses: Chocolate, Coffee, Meat, Mushroom, Tomato
R C Treatt & Co Ltd
Methyl-3(furfurylthio)propionate Kosher
Odor Description:Earthy
Taste Description:coffee, meaty, nutty
Used in onion, garlic, tomato, and meat flavours; and in chocolate, coffee and nuts flavours; in confectionery and snack foods, at 0.1-1.0ppm.
Taytonn
Methyl Furfurylmercaptopropionate
Odor Description:Earthy, Fruity, Sweet
 
Cosmetic Information:
None found
 
Suppliers:
Beijing Lys Chemicals
Methyl furfurylmercaptopropionate
BOC Sciences
For experimental / research use only.
methyl 3-(furfurylthio)propionate
Carbosynth
For experimental / research use only.
Methyl 3-(furfurylthio)propionate
DeLong Chemicals America
Methyl furfurylmercaptopropionate, Kosher
Endeavour Specialty Chemicals
Methyl 3-(furfurylthio)propionate 98% F&F
Speciality Chemical Product Groups
Frutarom
METHYL FURFURYLMERCAPTOPROPIONATE
Odor: Earthy, Fruity, Sweet
Use: Suggested Uses: Chocolate, Coffee, Meat, Mushroom, Tomato
Jiangyin Healthway
Methyl 3-(furfurylthio)propionate
New functional food ingredients
Penta International
METHYL FURFURYL MERCAPTOPROPIONATE
R C Treatt & Co Ltd
Methyl-3(furfurylthio)propionate
Kosher
Odor: Earthy
Flavor: coffee, meaty, nutty
Used in onion, garlic, tomato, and meat flavours; and in chocolate, coffee and nuts flavours; in confectionery and snack foods, at 0.1-1.0ppm.
Robinson Brothers
Methyl 3-(furfurylthio)propionate F&F
https://www.robinsonbrothers.uk/chemistry-competences
Sigma-Aldrich
Methyl furfuryl mercaptopropionate, ≥98%, FG
Odor: fruity; earthy; sweet
Certified Food Grade Products
Synerzine
Methyl Furfuryl Mercaptopropionate
Taytonn
Methyl Furfurylmercaptopropionate
Odor: Earthy, Fruity, Sweet
Tengzhou Jitian Aroma Chemiclal
Methyl3-furfurylthio propionate
WholeChem
Methyl furfurylmercaptopropionate
 
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 37/39 - Wear suitable gloves and eye/face protection.
 
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 methyl furfuryl mercaptopropionate usage levels up to:
 not for fragrance use.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.011 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 420 (μg/person/day)
Adequate NOAEL exists: Yes
Threshold of Concern:90 (μg/person/day)
Structure Class: III
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: 24
Click here to view publication 24
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: 0.100001.00000
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: 0.100001.00000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: --
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: 0.100001.00000
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
 
Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i).
Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.
 average usage mg/kgmaximum usage mg/kg
Dairy products, excluding products of category 02.0 (01.0): 0.500002.50000
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 0.200001.00000
Edible ices, including sherbet and sorbet (03.0): 0.500002.50000
Processed fruit (04.1): 0.400002.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 1.000005.00000
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 0.200001.00000
Bakery wares (07.0): 2.0000010.00000
Meat and meat products, including poultry and game (08.0): 0.200001.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 0.200001.00000
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 0.300001.50000
Foodstuffs intended for particular nutritional uses (13.0): 0.500002.50000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 0.200001.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 1.000005.00000
Ready-to-eat savouries (15.0): 2.0000010.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 0.400002.00000
 
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):

Scientific Opinion on Flavouring Group Evaluation 13Rev1: Furfuryl and furan derivatives with and without additional side-chain substituents and heteroatoms from chemical group 14
View page or View pdf

Consideration of sulfur-substituted furan derivatives used as flavouring agents evaluated by JECFA (59th meeting) structurally related to a subgroup of substances within the group of “Furfuryl and furan derivatives with and without additional side-chain substituents and heteroatoms from chemical group 14” evaluated by EFSA in FGE.13Rev1 (2009)
View page or View pdf

Flavouring Group Evaluation 67 (FGE.67): Consideration of 40 furan-substituted aliphatic hydrocarbons, alcohols, aldehydes, ketones, carboxylic acids and related esters, sulfides, disulfides and ethers evaluated by JECFA at the 65th meeting (JECFA, 2006b) and re-evaluated at the 69th meeting (JECFA, 2009c)
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 13, Revision 2 (FGE.13Rev2): Furfuryl and furan derivatives with and without additional side-chain substituents and heteroatoms from chemical group 14
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 67, Revision 1 (FGE.67Rev.1): Consideration of 40 furan-substituted aliphatic hydrocarbons, alcohols, aldehydes, ketones, carboxylic acids and related esters, sulfides, disulfides and ethers evaluated by JECFA at the 65th meeting (JECFA, 2006b) and re-evaluated at the 69th meeting (JECFA, 2009c)
View page or View pdf

EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :15225386
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
methyl 3-(2-furylmethylsulfanyl)propanoate
Chemidplus:0094278269
 
References:
 methyl 3-(2-furylmethylsulfanyl)propanoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:94278-26-9
Pubchem (cid):15225386
Pubchem (sid):135253540
 
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):Search
Export Tariff Code:2930.90.9999
ChemSpider:View
EFSA Update of results on the monitoring of furan levels in food:Read Report
EFSA Previous report: Results on the monitoring of furan levels in food:Read Report
EFSA Report of the CONTAM Panel on provisional findings on furan in food:Read Report
 
Potential Blenders and core components note
For Odor
earthy
methyl 3-hexenoate
FL/FR
fruity
butyl propionate
FL/FR
2-
methyl butyl isovalerate
FL/FR
(E)-7-
methyl-3-octen-2-one
FL/FR
octyl propionate
FL/FR
prunus amygdalus amara seed extract
FL/FR
fungal
methyl 2-furoate
FL/FR
green
melon acetal
FL/FR
mushroom
(R)-1-
octen-3-ol
FL/FR
nutty
2-
methyl-3-ethoxypyrazine
FL/FR
sulfurous
furfuryl thioacetate
FL/FR
woody
beta-
caryophyllene alcohol acetate
FL/FR
For Flavor
No flavor group found for these
beta-
caryophyllene alcohol acetate
FL/FR
furfural diethyl acetal
FL
2-
methyl-3-ethoxypyrazine
FL/FR
vitispirane
FL
caramellic
caramellic
methyl 2-furoate
FL/FR
estery
octyl propionate
FL/FR
fatty
(E)-7-
methyl-3-octen-2-one
FL/FR
fruity
butyl propionate
FL/FR
methyl 3-hexenoate
FL/FR
2-
methyl butyl isovalerate
FL/FR
green
melon acetal
FL/FR
mushroom
(R)-1-
octen-3-ol
FL/FR
nutty
prunus amygdalus amara seed extract
FL/FR
roasted
furfuryl thioacetate
FL/FR
sulfurous
3-
methyl-2-butane thiol
FL
 
Potential Uses:
FLchocolate
FLcoffee
 confection
FLgarlic
FLmeat
FLmushroom
FLnut
FLonion
FLtomato
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
3-((2-furanyl methyl)thio) propanoic acid methyl ester
3-((2-furanylmethyl)thio)-propanoic acid methyl ester
3-(furfurylthio)propionic acid methyl ester
 methyl 3-(2-furyl methyl sulfanyl) propanoate
 methyl 3-(2-furylmethylsulfanyl)propanoate
 methyl 3-(2-furylmethylthio)propanoate
 methyl 3-(furfuryl thio) propionate
 methyl 3-(furfurylthio)propionate
 methyl 3-[(2-furanylmethyl)thio]propanoate
 methyl 3-[(2-furylmethyl)thio]propionate
 methyl 3-[(furan-2-ylmethyl)sulfanyl]propanoate
 methyl furfurylmercaptopropionate
 methyl-3(furfurylthio)propionate
 methylfurfurylmercaptopropionate
 propanoic acid, 3-[(2-furanylmethyl)thio]-, methyl ester
 
 
Notes:
None found
Please share your Comments.
Email Address:
Top of Page Home
Copyright © 1980-2018 The Good Scents Company (tgsc) ™ Disclaimer Privacy Policy