methyl isopentyl disulfide

isopentyl methyl disulfide

CAS: 72437-56-0 C6 H14 S2 MW: 150.30758000 roasted

Identification

Namemethyl isopentyl disulfide
IUPAC3-methyl-1-methyldisulfanylbutane
CAS Number72437-56-0
FDA UNII0XDI7Q3QL3
Molecular FormulaC6 H14 S2
Molecular Weight150.30758000
Nikkaji NumberJ543.236G

Regulatory

JECFA Food Flavoring1696 methyl isopentyl disulfide
DG SANTE Food Flavourings12.294 isopentyl methyl disulfide
FEMA Number4168
FDANo longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF)72437-56-0 ; METHYL ISOPENTYL DISULFIDE

Physical Properties

Appearance colorless to yellow clear liquid (est)
Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Specific Gravity 0.99500 to 1.00100 @ 25.00 °C.
Pounds per Gallon - (est). 8.279 to 8.329
Refractive Index 1.51600 to 1.52200 @ 20.00 °C.
Boiling Point 184.00 to 200.00 °C. @ 760.00 mm Hg
Vapor Pressure 1.002000 mmHg @ 25.00 °C. (est)
Flash Point 134.00 °F. TCC ( 56.67 °C. )
logP (o/w) 4.032 (est)
Soluble in alcohol
Insoluble in water
Similar Items note

Organoleptic Properties

Taste Description sulfurous roasted

Safety Information

Oral/Parenteral ToxicityNot determined
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categoryflavoring agents
Recommendation for methyl isopentyl disulfide usage levels up tonot for fragrance use.
Maximised Survey-derived Daily Intakes (MSDI-EU)0.012 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA)ND (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI)300 (μg/person/day)
NOEL (No Observed Effect Level)7.3 (mg/kg bw per day)
Threshold of Concern1800 (μg/person/day)
Structure ClassI
baked goods0.25000
beverages(nonalcoholic)0.50000
beverages(alcoholic)-
breakfast cereal-
cheese-
chewing gum-
condiments / relishes-
confectionery froastings-
egg products-
fats / oils-
fish products-
frozen dairy0.25000
fruit ices-
gelatins / puddings0.25000
granulated sugar-
gravies-
hard candy-
imitation dairy-
instant coffee / tea-
jams / jellies-
meat products1.00000
milk products-
nut products-
other grains-
poultry-
processed fruits-
processed vegetables-
reconstituted vegetables-
seasonings / flavors-
snack foods-
soft candy-
soups-
sugar substitutes-
sweet sauces-
Dairy products, excluding products of category 02.0 (01.0)-
Fats and oils, and fat emulsions (type water-in-oil) (02.0)-
Edible ices, including sherbet and sorbet (03.0)0.25000
Processed fruit (04.1)-
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2)-
Confectionery (05.0)-
Chewing gum (05.3)-
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0)-
Bakery wares (07.0)0.25000
Meat and meat products, including poultry and game (08.0)1.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0)-
Eggs and egg products (10.0)-
Sweeteners, including honey (11.0)-
Salts, spices, soups, sauces, salads, protein products, etc. (12.0)-
Foodstuffs intended for particular nutritional uses (13.0)-
Non-alcoholic ("soft") beverages, excl. dairy products (14.1)0.50000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2)-
Ready-to-eat savouries (15.0)-
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0)0.25000

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Potential Uses

FL beef roasted beef FL chicory root FL chocolate cacao FL meat roasted meat FL nut roasted nut FL roasted

Natural Occurrence

found in nature

Synonyms

disulfide, isopentyl methyl disulfide, methyl 3-methylbutyl methyl 3-methyl butyl disulfide methyl 3-methylbutyl disulfide methyl isopentyl disulphide 3- methyl-1-(methyldisulfanyl)butane 3- methyl-1-methyldisulfanylbutane methylisopentyldisulfide iso pentyl methyl disulfide Try the PubMed Search.