sec-butyl isothiocyanate

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2-butylisothiocyanate

C5 H9 N S MW: 115.19873000 green

Identification

Namesec-butyl isothiocyanate
IUPAC(2S)-2-isothiocyanatobutane
EINECS224-609-8
FDA UNIISearch
Molecular FormulaC5 H9 N S
Molecular Weight115.19873000
MDL NumberMFCD00041108
Nikkaji NumberJ57.206C
XlogP32.80 (est)

Regulatory

JECFA Food Flavoring1890 2-butyl isothiocyanate
FEMA Number4419
FDANo longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF)4426-79-3 ; 2-BUTYLISOTHIOCYANATE

Physical Properties

Appearance colorless to yellow clear liquid (est)
Assay 97.00 to 100.00
Food Chemicals Codex Listed No
Specific Gravity 0.93800 to 0.94600 @ 25.00 °C.
Pounds per Gallon - (est). 7.805 to 7.872
Refractive Index 1.49000 to 1.49700 @ 20.00 °C.
Boiling Point 159.00 to 160.00 °C. @ 760.00 mm Hg
Vapor Pressure 3.240000 mmHg @ 25.00 °C. (est)
Flash Point 111.00 °F. TCC ( 43.89 °C. )
logP (o/w) 2.810
Soluble in alcohol
Insoluble in water
Similar Items note

Organoleptic Properties

Odor Description at 0.01 % in propylene glycol.

Safety Information

Preferred SDSView
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 sec-butyl isothiocyanate usage levels up tonot for fragrance use.
baked goods2.00000
beverages(nonalcoholic)1.00000
beverages(alcoholic)1.00000
breakfast cereal-
cheese0.50000
chewing gum5.00000
condiments / relishes15.00000
confectionery froastings-
egg products-
fats / oils1.00000
fish products1.00000
frozen dairy1.00000
fruit ices-
gelatins / puddings-
granulated sugar-
gravies1.00000
hard candy2.00000
imitation dairy1.00000
instant coffee / tea-
jams / jellies-
meat products0.50000
milk products-
nut products0.50000
other grains-
poultry-
processed fruits-
processed vegetables0.50000
reconstituted vegetables0.50000
seasonings / flavors5.00000
snack foods1.00000
soft candy2.00000
soups0.50000
sugar substitutes-
sweet sauces-

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4426-79-3 2-Butyl isothiocyanate
View All Website 1-631-485-4226 account@bocsci.com

Penta International Corporation

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02-62855 2-BUTYL ISOTHIOCYANATE
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TCI AMERICA

Moving Your Chemistry Forward

We continuously strive to advance our technology.

I0481 sec-Butyl Isothiocyanate >98.0%(GC)
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Potential Uses

FL horseradish FL mustard FL radish FL wasabi

Natural Occurrence

brassica rapa broccoli asparagus broccoli plant broccoli asparagus broccoli seed brussel sprout seed cabbage seed cardamine amara horseradish seed lepidium latifolium sisymbrium loeselii

Synonyms

butan-2-isothiocyanate butane, 2-isothiocyanato- butane,2-isothiocyanato- 2- butyl isothiocyanate 2- butylisothiocyanate sec- butylisothiocyanate 1- methyl propyl isothiocyanate 1- methylpropyl isothiocyanate 2-iso thiocyanato-butane 2-iso thiocyanatobutane iso thiocyanic acid 2-butyl ester iso thiocyanic acid sec-butyl ester iso thiocyanic acid, sec-butyl ester Try the PubMed Search.