Allyl isothiocyanate, 94%, stab.

Description

CAS: 57-06-7 | C4H5NS | 99.151 g/mol

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar 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
• Molecular Formula: C4H5NS
• Molecular Weight (g/mol): 99.151
• 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

• Melting Point: -80°C
• Density: 1.013
• Boiling Point: 149°C to 151°C
• Flash Point: 46°C (114°F)
• Odor: Pungent
• Refractive Index: 1.53
• Quantity: 50 g
• UN Number: UN1545
• Beilstein: 773748
• Sensitivity: Moisture sensitive
• Merck Index: 14,295
• Formula Weight: 99.16
• Percent Purity: 94%
• Chemical Name or Material: Allyl isothiocyanate, stabilized

Safety and Handling

Hazard Category	H226-H301-H310+H330-H315-H319-H335
Hazard Statement	GHS H Statement H301-H310-H331-H318-H226-H315-H335 Toxic if swallowed. Fatal in contact with skin. Toxic if inhaled. Causes serious eye damage. Flammable liquid and vapor. Causes skin irritation. May cause respiratory irritation.
Precautionary Statement	P210-P233-P235-P240-P241-P242-P243-P260-P262-P264b-P270-P271-P280-P284-P301+P310-P303+P361+P353-P304+P340-P305+P351+P338-P310-P312-P330-P332+P313-P363-P370+P378q-P501c
DOTInformation	Transport Hazard Class: 6.1; Packing Group: II; Proper Shipping Name: ALLYL ISOTHIOCYANATE, STABILIZED
EINECSNumber	200-309-2
RTECSNumber	NX8225000
TSCA	Yes
Recommended Storage	Keep cold

SDS

RUO – Research Use Only