4-Methylbenzyl isothiocyanate, 96%, Thermo Scientific Chemicals

Description

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: 3694-46-0
• Molecular Formula: C9H9NS
• Molecular Weight (g/mol): 163.238
• MDL Number: MFCD00041118
• InChI Key: OAXIUBJXQISJEV-UHFFFAOYSA-N
• Synonym: 4-methylbenzyl isothiocyanate, 1-isothiocyanatomethyl-4-methylbenzene, p-methylbenzyl isothiocyanate, benzene, 1-isothiocyanatomethyl-4-methyl, isothiocyanic acid, p-methylbenzyl ester, benzene, 1-isothiocyanatomethyl-4-methyl-9ci, acmc-1cobu, 4-methylbenzylisothiocyanate, wln: scn1r d1, 4-12-00-02578 beilstein handbook reference
• PubChem CID: 19409
• IUPAC Name: 1-(isothiocyanatomethyl)-4-methylbenzene
• SMILES: CC1=CC=C(C=C1)CN=C=S

• Density: 1.08
• Boiling Point: 97°C (1 mmHg)
• Odor: Pungent
• Refractive Index: 1.589
• Quantity: 10 g
• UN Number: UN2922
• Beilstein: 2082478
• Sensitivity: Moisture sensitive
• Formula Weight: 163.24
• Percent Purity: 96%
• Chemical Name or Material: 4-Methylbenzyl isothiocyanate

Safety and Handling

Hazard Category	H302+H312+H332-H314-H335
Hazard Statement	GHS H Statement H331-H314-H318-H302-H312 Toxic if inhaled. Causes severe skin burns and eye damage. Causes serious eye damage. Harmful if swallowed. Harmful in contact with skin.
Precautionary Statement	P260-P264b-P270-P271-P280-P303+P361+P353-P304+P340-P305+P351+P338-P310-P330-P331-P363-P501c
DOTInformation	Transport Hazard Class: 8; Packing Group: III; Proper Shipping Name: CORROSIVE LIQUIDS, TOXIC, N.O.S.
EINECSNumber	000-000-0
RTECSNumber	NX8860000
TSCA	No
Recommended Storage	Ambient temperatures

SDS

RUO – Research Use Only