57825-33-9

Basic information

• Product Name: PHENYL(ACETIC ACID-1-13C)
• Synonyms: PHENYL(ACETIC ACID-1-13C);PHENYLACETIC ACID-CARBOXY-13C;phenylacetic-carboxy-13C acid;PHENYLACETIC-CARBOXY-13C ACID, 99 ATOM % 13C
• CAS NO: 57825-33-9
• Molecular Formula: C₈H₈O₂
• Molecular Weight: 137.16
• Mol File: 57825-33-9.mol
• Article Data: 14

Chemical Properties

• Melting Point: 77-79 °C(lit.)
• Boiling Point: 265 °C(lit.)
• Appearance: /
• Density: 1.089 g/mL at 25 °C
• CAS DataBase Reference: PHENYL(ACETIC ACID-1-13C)(CAS DataBase Reference)
• NIST Chemistry Reference: PHENYL(ACETIC ACID-1-13C)(57825-33-9)
• EPA Substance Registry System: PHENYL(ACETIC ACID-1-13C)(57825-33-9)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36
• WGK Germany: 3
• Hazardous Substances Data: 57825-33-9(Hazardous Substances Data)

Upstream product

• 1111-72-4 carbon dioxide 
• 1589-82-8 phenylmagnesium bromide 
• 100-44-7 benzyl chloride 
• 51956-33-3 [13C]barium carbonate 
• 83552-81-2 <1-13C>-phenylacetonitrile 
• 6921-34-2 benzylmagnesium chloride 
• 25909-68-6 [¹³C]-potassium cyanide 
• 100-39-0 benzyl bromide 
• 39762-95-3 [Carbonyl-13C]1-Oxo-2-diazo-1-phenylethan 
• 10383-88-7 acetophenone-13C=O 
• 3880-99-7 1-(13C)benzoic acid 
• 616874-17-0 [4-13C]4-Oxo-4-phenyl-1,1,1-trifluorbutan-2-on 
• 103-80-0 phenylacetyl chloride 
• 13005-36-2 potassium phenylacetate 

Downstream Products

• 142038-80-0 methyl phenyl<1-13C>acetate 
• 78064-70-7 <1-(13)C>-2-Phenylacetaldehyde 
• 936140-76-0 [1-⁽¹³⁾C]4-(2-bromophenyl)-2-phenylbutyric acid 
• 936140-77-1 [2-⁽¹³⁾C]3-[4-(2-bromophenyl)-2-phenylbutyryl]-4,4-dimethyloxazolidin-2-one 
• 1026360-04-2 [1-⁽¹³⁾C]4-(2-bromophenyl)-2-phenylbutyryl chloride 
• 54522-92-8 phenylacetylene-2-13C 
• 549548-77-8 (E)-(β-13C)-β-bromostyrene 
• 10383-90-1 ⁽¹³⁾C-benzaldehyde 
• 156245-69-1 phenyl<1-13C,1-2H>acetaldehyde 
• 156245-68-0 2-phenyl<1-13C,1-2H2>ethanol 
• 1028274-20-5 C₈⁽¹³⁾CH₈⁽²⁾HNO 
• 61415-37-0 <1-13C>-2-Phenylaethen 

Relevant articles and documents

Conversion of InP Clusters to Quantum Dots

Understanding and deconvoluting the different mechanisms involved in the synthesis of nanomaterials is necessary to make uniform materials with desirable function. In this study, in situ spectroscopic methods were used to study exchange reactions at the s

Photochemical Strategy for Carbon Isotope Exchange with CO2

A photocatalytic approach for carbon isotope exchange is reported. Utilizing [13C]CO2 and [14C]CO2 as primary C1 sources, this protocol allows the insertion of the desired carbon isotope into phenyl acetic acids without the need for structural modifications or prefunctionalization in one single step. The exceptionally mild conditions required for this traceless transformation are in stark contrast with those for previous methods requiring the use of harsh thermal conditions.

Direct reversible decarboxylation from stable organic acids in dimethylformamide solution

Many classical and emerging methodologies in organic chemistry rely on carbon dioxide (CO2) extrusion to generate reactive intermediates for bond-forming events. Synthetic reactions that involve the microscopic reverse-the carboxylation of reactive intermediates-have conventionally been undertaken using very different conditions. We report that chemically stable C(sp3) carboxylates, such as arylacetic acids and malonate half-esters, undergo uncatalyzed reversible decarboxylation in dimethylformamide solution. Decarboxylation-carboxylation occurs with substrates resistant to protodecarboxylation by Br?nsted acids under otherwise identical conditions. Isotopically labeled carboxylic acids can be prepared in high chemical and isotopic yield by simply supplying an atmosphere of 13CO2 to carboxylate salts in polar aprotic solvents. An understanding of carboxylate reactivity in solution enables conditions for the trapping of aldehydes, ketones, and a,b-unsaturated esters.