(R,S)-2-mercapto-3-butanol

2-mercapto-3-butanol

CAS: 37887-04-0 C4 H10 O S MW: 106.18790000 sulfurous meaty

Identification

Name(R,S)-2-mercapto-3-butanol
CAS Number37887-04-0
EINECS253-701-0
FDA UNII82S57584XS
Molecular FormulaC4 H10 O S
Molecular Weight106.18790000
MDL NumberMFCD00010271
Nikkaji NumberJ264.795H
CoE Number760

Regulatory

JECFA Food Flavoring546 2-mercapto-3-butanol
DG SANTE Food Flavourings12.024 2-mercapto-3-butanol
FEMA Number3502
FDANo longer provide for the use of these seven synthetic flavoring substances

Physical Properties

Appearance colorless clear liquid (est)
Assay 97.00 to 100.00 sum of isomers
Food Chemicals Codex Listed No
Specific Gravity 1.00500 to 1.02000 @ 25.00 °C.
Pounds per Gallon - (est). 8.363 to 8.487
Refractive Index 1.47500 to 1.49000 @ 20.00 °C.
Boiling Point 53.00 °C. @ 10.00 mm Hg
Vapor Pressure 0.750000 mmHg @ 25.00 °C. (est)
Flash Point 134.00 °F. TCC ( 56.67 °C. )
logP (o/w) 0.477 (est)
Soluble in alcohol
Insoluble in water

Organoleptic Properties

Odor Description
at 0.10 % in propylene glycol.
SuIfureous, roasted meat, alliaceous, sauteed onion and garlic
Taste Description at 4.00 ppm.

Safety Information

Preferred SDSView
European informationMost important hazard(s):
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 (R,S)-2-mercapto-3-butanol usage levels up tonot for fragrance use.
Maximised Survey-derived Daily Intakes (MSDI-EU)4.00 (μg/capita/day)
NOEL (No Observed Effect Level)1.9 (mg/kg bw per day)
Structure ClassI
baked goods-
beverages(nonalcoholic)-
beverages(alcoholic)-
breakfast cereal-
cheese-
chewing gum-
condiments / relishes-
confectionery froastings-
egg products-
fats / oils-
fish products-
frozen dairy-
fruit ices-
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-
soft candy-
soups-
sugar substitutes-
sweet sauces-

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R C Treatt and Co Ltd

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Potential Uses

FL candy FL chicken FR coffee FL currant black currant FL fruit tropical fruit FL garlic FL meat FL onion FL savory

Natural Occurrence

not found in nature

Synonyms

(R,S)-2- butanol, 3-mercapto- (R,S)-3- hydroxy-2-butane thiol (R,S)-2- hydroxy-3-butane thiol (R,S)-2- hydroxy-3-butanethiol (R,S)-2- mercapto 3-butanol (R,S)-3- mercapto-2-butanol (theta,S)-3- mercapto-2-butanol 2- mercapto-3-butanol (R*,S*)-3- mercaptobutan-2-ol (2R,3S)-3- sulfanylbutan-2-ol thionol-935 (IFF) US Patents: 6,610,346 - Mercapto-alkanol flavor compounds US Patents: 3,959,509 - Flavoring foodstuffs using sulfur-containing compounds