Substance
ID:365636
Names and Identifiers
Synonyms
AITCOil of mustard芥子油异硫氰酸烯丙酯Allyl isothiocyanate
IUPAC Traditional name
allyl isothiocyanate
IUPAC name
3-isothiocyanatoprop-1-ene
Registration numbers
CAS Number
MDL Number
Beilstein Number
PubChem SID
Properties
Product Information
Contains
0.1% BHT as stabilizer
Grade
purum
Purity
≥98% (GC)
Linear Formula
CH2=CHCH2NCS
Physical Property
Boiling Point
150 °C(lit.)
Refractive Index
n20/D 1.529(lit.)
n20/D 1.530
Density
1.013 g/mL at 25 °C(lit.)
Melting Point
-80 °C(lit.)
Safety Information
European Hazard Symbols
Toxic (T)
Nature polluting (N)MSDS Link
GHS Precautionary statements
P261-P273-P280-P301+P310-P302+P350-P305+P351+P338
GHS Pictograms
Respiratory sensitization, category 1
Germ cell mutagenicity, categories 1A,1B,2
Carcinogenicity, categories 1A,1B,2
Reproductive toxicity, categories 1A,1B,2
Specific Target Organ Toxicity – Single exposure, categories 1,2
Specific Target Organ Toxicity – Repeated exposure, categories 1,2
Aspiration Hazard, category 1
Hazardous to the aquatic environment
Acute hazard, category1
Chronic hazard, categories 1,2
Acute toxicity (oral, dermal, inhalation), categories 1,2,3
RID/ADR
UN 1545 6.1/PG 2
Packing Group
2
Safety Statements
23-26-36/37-45-61
GHS Hazard statements
H301+H331-H310-H315-H317-H319-H334-H410
German water hazard class
3
GHS Signal Word
Danger
Risk Statements
23/24/25-36/37/38-42/43-50/53
Storage Temperature
2-8°C
Hazard Class
6.1
Personal Protective Equipment
Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
UN Number
1545
Molecule Details
Biochem/physiol Actions
Naturally occurring constituent of cruciferous vegetables that has anti-tumor and anti-oxidant properties. Induces the activity of phase II detoxification enzymes in the urinary bladder and, thus, may be chemoprotective against bladder cancer.
Naturally occurring constituent of cruciferous vegetables that has anti-tumor and anti-oxidant properties. Induces the activity of phase II detoxification enzymes in the urinary bladder and, thus, may be chemoprotective against bladder cancer.
Molecular Spectra
No Data Available
Click here to submit data
References
No Data Available
Click here to submit data