3-Phenylpropionitrile, 98%

Description

CAS: 645-59-0 | C9H9N | 131.178 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: 645-59-0
• Molecular Formula: C9H9N
• Molecular Weight (g/mol): 131.178
• MDL Number: MFCD00001961
• InChI Key: ACRWYXSKEHUQDB-UHFFFAOYSA-N
• Synonym: 3-phenylpropionitrile, benzenepropanenitrile, hydrocinnamonitrile, 2-phenylethyl cyanide, benzenepropionitrile, 2-cyanoethyl benzene, 3-phenylpropiononitrile, phenylpropionitrile, phenethyl cyanide, hydrocinnamique nitrile
• PubChem CID: 12581
• ChEBI: CHEBI:85426
• IUPAC Name: 3-phenylpropanenitrile
• SMILES: C1=CC=C(C=C1)CCC#N

• Melting Point: -2°C
• Density: 1.008
• Boiling Point: 261°C
• Flash Point: >110°C (230°F)
• Refractive Index: 1.521
• Quantity: 10 g
• UN Number: UN3276
• Beilstein: 636348
• Formula Weight: 131.18
• Percent Purity: 98%
• Chemical Name or Material: 3-Phenylpropionitrile

Safety and Handling

Hazard Category	H301-H311-H331
Hazard Statement	GHS H Statement H301 Toxic if swallowed.
Precautionary Statement	P261-P264b-P270-P271-P280-P301+P310-P302+P352-P304+P340-P311-P312-P330-P361-P363-P501c
DOTInformation	Transport Hazard Class: 6.1; Packing Group: III; Proper Shipping Name: NITRILES, LIQUID, TOXIC, N.O.S.
EINECSNumber	211-447-8
RTECSNumber	MW5604750
TSCA	Yes
Recommended Storage	Ambient temperatures

SDS

RUO – Research Use Only