Basic information Safety Use Synthesis Preparation Products And Raw materials Spectrum Related
Allyl isothiocyanate Structure

Allyl isothiocyanate

Chemical Properties

Melting point -80 °C
Boiling point 151 °C
Density  1.013 g/mL at 25 °C(lit.)
refractive index  n20/D 1.529(lit.)
FEMA  2034 | ALLYL ISOTHIOCYANATE
Flash point 115 °F
storage temp.  2-8°C
solubility  Chloroform (Sparingly), Methanol (Slightly)
form  Fine Crystalline Powder
color  White
Odor at 0.01 % in propylene glycol. strong pungent mustard
Odor Type sulfurous
Water Solubility  2 g/L (20 ºC)
Sensitive  Moisture Sensitive
Merck  14,295
JECFA Number 1560
BRN  773748
Dielectric constant 17.199999999999999
Stability Stable. Combustible. Incompatible with oxidizing agents, acids, water, alcohols, strong bases, amines. Darkens on aging.
LogP 2.15
Substances Added to Food (formerly EAFUS) ALLYL ISOTHIOCYANATE
SCOGS (Select Committee on GRAS Substances) Allyl isothiocyanate
Mustard and Oil of Mustard (Brown and Yellow)
FDA 21 CFR 310.545
CAS DataBase Reference 57-06-7(CAS DataBase Reference)
FDA UNII BN34FX42G3
IARC 3 (Vol. 73, Sup 7) 1999
NIST Chemistry Reference Allyl isothiocyanate(57-06-7)
EPA Substance Registry System Allyl isothiocyanate (57-06-7)

Safety

Symbol(GHS)
Signal wordDanger
Hazard statements H226-H302-H310+H330-H314-H317-H410
Precautionary statements P210-P273-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
Hazard Codes  T,N
Risk Statements  10-24/25-36/37/38-42/43-50/53-43-23/24/25-34-25
Safety Statements  26-36/37-45-60-61-36/37/39-28B-24-16-23-7/8
RIDADR  UN 1545 6.1/PG 2
WGK Germany  3
RTECS  NX8225000
8-9-13-19
TSCA  Yes
HazardClass  6.1
PackingGroup  II
HS Code  29309070
Hazardous Substances Data 57-06-7(Hazardous Substances Data)
Toxicity LD50 orally in rats: 339 mg/kg (Jenner)
NFPA 704:
2
3 1

Allyl isothiocyanate Chemical Properties,Usage,Production

Allyl isothiocyanate synthesis