Allyl isothiocyanate, 94%, stabilized with 0.01% alpha-tocopherol, Thermo Scientific Chemicals

Description

This Thermo Scientific Chemicals brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Specifications

Chemical Identifiers

• CAS: 57-06-7
• MDL Number: MFCD00004822
• InChI Key: ZOJBYZNEUISWFT-UHFFFAOYSA-N
• Synonym: allyl isothiocyanate, mustard oil, redskin, allylsenevol, allylsenfoel, allyl mustard oil, oleum sinapis, oil of mustard, allylsevenolum, senfoel
• PubChem CID: 5971
• ChEBI: CHEBI:73224
• IUPAC Name: 3-isothiocyanatoprop-1-ene
• SMILES: C=CCN=C=S

• CAS Min %: 92.0
• CAS Max %: 100.0
• Melting Point: -80.0°C
• Color: White
• Density: 1.0175g/mL
• Boiling Point: 151.0°C to 153.0°C
• Flash Point: 46°C
• Infrared Spectrum: Authentic
• Assay Percent Range: 94%
• Packaging: Glass bottle
• Molecular Formula: C4H5NS
• Linear Formula: H₂C=CHCH₂NCS
• Refractive Index: 1.5290 to 1.5310
• Quantity: 500 g
• Beilstein: 04, 214
• Merck Index: 15, 286
• Stabilizer: 0.01% alpha-tocopherol
• Molecular Weight (g/mol): 99.151
• Formula Weight: 99.15
• Percent Purity: 94%
• Physical Form: Fine Crystalline Powder
• Chemical Name or Material: Allyl isothiocyanate, 94%

Safety and Handling

Product Identifier

• Allyl isothiocyanate, stabilized

Signal Word

• Danger

Hazard Category

• Acute toxicity Category 2
• Acute toxicity Category 3
• LONG-TERM AQUATIC HAZARD Chronic 1
• ACUTE AQUATIC Acute 1
• Serious eye damage/eye irritation Category 2
• Flammable liquid Category 3
• Skin corrosion/irritation Category 2
• Specific target organ toxicity Category 3

Hazard Statement

• H400-Very toxic to aquatic life.
• H410-Very toxic to aquatic life with long lasting effects.
• H310-Fatal in contact with skin.
• H315-Causes skin irritation.
• H319-Causes serious eye irritation.
• H330-Fatal if inhaled.
• H301-Toxic if swallowed.
• H335-May cause respiratory irritation.
• H226-Flammable liquid and vapour.

Precautionary Statement

• P210-Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.
• P280-Wear protective gloves/protective clothing/eye protection/face protection.
• P304+P340-IF INHALED: Remove person to fresh air and keep comfortable for breathing.
• P310-Immediately call a POISON CENTER/doctor/.
• P332+P313-If skin irritation occurs: Get medical advice/attention.
• P337+P313-If eye irritation persists: Get medical advice/attention.

RUO – Research Use Only