furfuryl isopropyl sulfide
Suppliers  organoleptics  properties  safety  references    FEMA Index    Home Page
 
Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here.
 
IUPAC name :2-(propan-2-ylsulfanylmethyl)furan
InChI :InChI=1/C8H12OS/c1-7(2)10-6-8-4-3-5-9-8/h3-5,7H,6H2,1-2H3
InChIKey :WCHRNAKORAINOJ-UHFFFAOYAP
SMILES :CC(C)SCC1=CC=CO1
cas number :1883-78-9
fema number :3161
coe number :2248
jecfa number :1077
fl. number :13.032
molar refractivity :45.32 ± 0.3 cm3
parachor :365.4 ± 4.0 cm3
index of refraction :1.506 ± 0.02
surface tension :33.0 ± 3.0 dyne/cm
density :1.025 ± 0.06 g/cm3
polarizability :17.96 ± 0.5 10-24cm3
XlogP : 2.10
molecular weight : 156.2452800 (IUPAC)
formula :C8 H12 O S
NMR Predictor :Predict
 
 
export tariff code :2932.10
fda reg :unspecified
Suppliers :
Endeavour :Furfuryl isopropyl sulphide
99%
Frutarom :FURFURYL ISOPROPYL SULPHIDE
≥98.00%, Kosher
Odor:  Alliaceous, Floral, Gassy
Suggested Uses: Bakery, Dairy Products, Savoury
Penta :furfuryl isopropyl sulfide
SAFC Global® :Furfuryl isopropyl sulfide
≥98%
Odor:  meaty; coffee; alliaceous (onion, garlic)
Treatt :Furfuryl isopropyl sulphide
organoleptics :
odor type :coffee
odor strength :high ,
recommend smelling in a 0.10 % solution or less
odor description:
at 0.10 % in dipropylene glycol.  		coffee savory meaty floral
properties :
appearence :amber brown clear liquid
assay : 98.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.01000 to 1.02000 @ 25.00 °C.
pounds per gallon - calc. : 8.404 to 8.487
refractive index :1.50100 to 1.50800 @ 20.00 °C.
boiling point : 79.00 to 80.00 °C. @ 12.00 mm Hg
boiling point : 84.00 °C. @ 16.00 mm Hg
vapor density :5.3 ( Air = 1 )
flash point : 168.00  °F.  TCC  ( 75.56 °C. )
logP (o/w) : 2.60
safety :
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.
Oral Toxicity(LD50) : 
  Not determined
Dermal Toxicity(LD50) : 
  Not determined
Inhalation Toxicity(LC50) : 
  Not determined
 
safety in use :
Category :flavoring agents
Maximised Survey-derived Daily Intakes (MSDI-EU) :0.0012 (μg/capita/day)
 
recommendation for furfuryl isopropyl sulfide fragrance usage levels up to :
 not for fragrance use.
recommendation for furfuryl isopropyl sulfide flavor usage levels up to :
  0.5000 ppm in the flavor.
safety references :
European Food Safety Athority(efsa) :Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :3
 
 
 
 
2-(propan-2-ylsulfanylmethyl)furan
chemidplus :001883789
EPA Substance Registry Services :1883-78-9
references :
 
2-(propan-2-ylsulfanylmethyl)furan
fl. number :13.032
jecfa number :1077
NIST Chemistry WebBook :2380787896
pubchem :197547
other :
FDA Everything Added to Food in the United States (EAFUS)View
synonyms :
2-(propan-2-ylsulfanylmethyl)furan
isopropyl furfuryl sulfide
soluble in :
 alcohol
insoluble in :
 water
potential blenders :    note
2-acetyl furanFL/FR
2-acetyl pyrazineFL/FR
4-aminobutyric acidFL
 benzothiazoleFL
 benzyl mercaptanFL
 butyl mercaptanFL
 caramel furanoneFL
 cocoa pyrazineFL/FR
 coffee difuranFL
 coffee dioneFL/FR
 coffee pyrazineFL
 dicyclohexyl disulfideFL
 difurfuryl etherFL
 difurfuryl sulfideFL
 diisoamyl thiomalateFL
N-(2-(3,4-dimethoxyphenyl)ethyl)-3,4-dimethoxycinnamic acid amideFL
2,3-dimethyl pyrazineFL/FR
2,6-dimethyl pyrazineFL/FR
2,4-dimethyl thiazoleFL
 dimethyl trisulfideFL/FR
4,5-dimethyl-2-ethyl-3-thiazolineFL
2,5-dimethyl-3-thiofuroyl furanFL
 ethyl 3-(furfuryl thio) propionateFL
 ethyl methyl sulfideFL
S-ethyl thioacetateFL
2-ethyl-3,5(6)-dimethyl pyrazine mixtureFL
 filbert heptenoneFL/FR
 furfuryl alcoholFL
 furfuryl isopropyl sulfideFL
 furfuryl mercaptanFL/FR
 furfuryl methyl etherFL
 furfuryl propionateFL
1-furfuryl pyrroleFL/FR
 furfuryl thioacetateFL
S-furfuryl thioformateFL
 furfuryl thiopropionateFL
1-hydroxy-2-butanoneFL/FR
 menthofuranFL/FR
N1-(2-methoxy-4-methyl benzyl)-N2-2(2-(5-methyl pyridin-2-yl)ethyl) oxalamideFL
2-methyl 3-(methyl thio) furan 10% in triacetinFL
2-methyl 5-(methyl thio) furanFL
2-methyl butyraldehydeFL
 methyl cyclopentenoloneFL/FR
 methyl furfuryl disulfideFL
2-methyl quinoxalineFL
5-methyl quinoxalineFL/FR
2-methyl thio-3,5 or 6-methyl pyrazineFL/FR
2-methyl-3-,5 or 6-(furfuryl thio) pyrazineFL/FR
2-methyl-5-isopropyl pyrazineFL
1,9-nonane dithiolFL
2,3,5,6-tetramethyl pyrazineFL
2-thienyl mercaptanFL
2-thiophene thiolFL
2,4,5-trimethyl thiazoleFL/FR
2,6-xylenolFR
potential uses :
 bakery
 coffee
 dairy
 savory
natural occurrence in :    note
 not found in nature  

information only - not sold by The Good Scents Company.


Please share your Information / Comments.

Your email Address:


Top of Page          The Good Scents Company Home
Copyright © 1980-2010 The Good Scents Company Disclaimer Privacy Policy
Html Last modified 03/10/2010