4-methyl thiobutyl isothiocyanate

Full Material List
1-isothiocyanato-4-methylsulfanylbutane

Identifiers

FEMA 4414
CAS 4430-36-8
EINECS N/A
Synonyms
  • butane, 1-isothiocyanato-4-(methylthio)-
  • butane,1-isothiocyanato-4-(methylthio)-
  • erucin
  • 4-( methyl thio) butyl isothiocyante
  • 4-( methylthio)butyl isothiocyanate
  • 4-( methylthio)butyl thiocyante
  • 4- methylthiobutyl isothiocyanate
  • 1-iso thiocyanato-4-(methyl thio) butane
  • 1-iso thiocyanato-4-(methylsulfanyl)butane
  • 1-iso thiocyanato-4-(methylthio)butane
  • 1-iso thiocyanato-4-methylsulfanylbutane
  • 4-iso thiocyanatobutyl methyl sulfide
  • (4-iso thiocyanatobutyl)(methyl)sulfane
JECFA Food Flavoring 1892
JECFA Food Additive N/A
DG SANTE Food Flavourings N/A
DG SANTE Food Contact Materials N/A
FDA UNII CTE370DL3U
CoE Number N/A
XlogP3-AA N/A
Molecular Weight 161.29067
Molecular Formula C6 H11 N S2

Organoleptic

Organoleptic Notes
  • 1. Odor Type: cabbage cabbage radish
  • Odor Description:at 0.01 % in propylene glycol. cabbage radish
  • Odor and/or flavor descriptions from others (if found).
Odor cabbage
cabbage, radish,
Flavor N/A

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Properties

Food Chemicals Codex Listed No
Appearance pale yellow to red brown clear liquid (est)
Assay 98.00 to 100.00
Specific Gravity 1.08000 to 1.08600 @ 20.00 °C.
Lbs/Gal (est) 8.997 to 9.047
Refractive Index 1.55100 to 1.55600 @ 20.00 °C.
Melting Point N/A
Boiling Point 250.00 to 251.00 °C. @ 760.00 mm Hg (est)
Flash Point 221.00 °F. TCC ( 105.00 °C. )
Acid Value N/A
Vapor Pressure 0.034000 mmHg @ 25.00 °C. (est)
Vapor Density N/A
logP (o/w) 2.672 (est)
Soluble In
  • alcohol
  • water, very slightly
  • water, 243.9 mg/L @ 25 °C (est)
  • water
Occurrence
  • broccoli
  • brussel sprout
  • cabbage leaf
  • kohlrabi stem