butyl isothiocyanate

Full Material List
1-isothiocyanatobutane

Identifiers

FEMA 4082
CAS 592-82-5
EINECS 209-770-4
Synonyms
  • butane, 1-isothiocyanato-
  • butanisothiocyanate
  • 1- butyl isothiocyanate
  • N- butyl isothiocyanate
  • butyl mustard oil
  • N- butyl mustard oil
  • butylisothiocyanate
  • N- butylisothiocyanate
  • 1-iso thiocyanatobutane
  • iso thiocyanic acid butyl ester
  • iso thiocyanic acid, butyl ester
JECFA Food Flavoring 1561
JECFA Food Additive N/A
DG SANTE Food Flavourings 12.107 butyl isothiocyanate
DG SANTE Food Contact Materials N/A
FDA UNII 4Y31800S6C
CoE Number 11488
XlogP3-AA 2.90 (est)
Molecular Weight 115.19873
Molecular Formula C5 H9 N S

Organoleptic

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

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Properties

Food Chemicals Codex Listed No
Appearance pale yellow to yellow clear liquid (est)
Assay 98.00 to 100.00
Specific Gravity 0.95800 to 0.96400 @ 25.00 °C.
Lbs/Gal (est) 7.972 to 8.021
Refractive Index 1.99300 to 1.50400 @ 20.00 °C.
Melting Point N/A
Boiling Point 168.00 °C. @ 760.00 mm Hg
Flash Point 151.00 °F. TCC ( 66.11 °C. )
Acid Value 1.00 max. KOH/g
Vapor Pressure 2.550000 mmHg @ 25.00 °C.
Vapor Density N/A
logP (o/w) 2.92
Soluble In
  • alcohol
  • oils
  • propylene glycol
  • water, 335.1 mg/L @ 25 °C (est)
  • water
Occurrence
  • cleome anomala
  • horseradish plant