3-Phenylpropionaldehyde, 95%

Description

CAS: 104-53-0 | C9H10O | 134.178 g/mol

3-Phenylpropionaldehyde is used as a flavoring agent. It is also used in the preparation of cinnamaldehyde, 2-chloro hydrocinnamaldehyde by alfa chlorination and mixture of homopropargyl alcohols. It serves as a precursor for the synthesis of mixture of syn- and anti-beta-hydroxyallylsilanes by hydroboration of allenylsilane. It is also involved in the catalytic asymmetric cyanosilylation to prepare (2S)-2-hydroxy-4-phenylbutanenitrile. Further, it undergoes Henry reaction to form nitroaldols by reacting with nitromethane.

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.

Applications
3-Phenylpropionaldehyde is used as a flavoring agent. It is also used in the preparation of cinnamaldehyde, 2-chloro hydrocinnamaldehyde by alfa chlorination and mixture of homopropargyl alcohols. It serves as a precursor for the synthesis of mixture of syn- and anti-beta-hydroxyallylsilanes by hydroboration of allenylsilane. It is also involved in the catalytic asymmetric cyanosilylation to prepare (2S)-2-hydroxy-4-phenylbutanenitrile. Further, it undergoes Henry reaction to form nitroaldols by reacting with nitromethane.

Solubility
Miscible with chloroform, dichloromethane, ethyl acetate, alcohol and ether. Immiscible with water.

Notes
Incompatible with strong oxidizing agents and strong bases.

Specifications

Chemical Identifiers

• CAS: 104-53-0
• Molecular Formula: C9H10O
• Molecular Weight (g/mol): 134.178
• MDL Number: MFCD00007021
• InChI Key: YGCZTXZTJXYWCO-UHFFFAOYSA-N
• Synonym: benzenepropanal, 3-phenylpropionaldehyde, hydrocinnamaldehyde, hydrocinnamic aldehyde, dihydrocinnamaldehyde, benzylacetaldehyde, 3-phenyl-1-propanal, 3-phenylpropylaldehyde, 3-phenylpropyl aldehyde, propanal, phenyl
• PubChem CID: 7707
• IUPAC Name: 3-phenylpropanal
• SMILES: C1=CC=C(C=C1)CCC=O

• Melting Point: °C to 42°C
• Density: 1.017
• Boiling Point: 222°C to 223°C
• Flash Point: 95°C (203°F)
• Refractive Index: 1.523
• Linear Formula: C₆H₅(CH₂)₂CHO
• Quantity: 50 g
• Beilstein: 1071910
• Sensitivity: Air Sensitive
• Solubility Information: Miscible with chloroform,dichloromethane,ethyl acetate,alcohol and ether. Immiscible with water.
• Formula Weight: 134.18
• Percent Purity: 95%
• Chemical Name or Material: 3-Phenylpropionaldehyde

Safety and Handling

Hazard Category	H315-H319-H335
Hazard Statement	GHS H Statement H315-H319-H335
Precautionary Statement	P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P362-P501c
EINECSNumber	203-211-8
RTECSNumber	MW4890000
TSCA	Yes
Recommended Storage	Ambient temperatures; Store under Nitrogen

SDS

RUO – Research Use Only