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α-Deuterio-3-phenylpropionic acid is a deuterated analog of 3-phenylpropionic acid, a chemical compound with the molecular formula C9H9DO2. It is characterized by the presence of a deuterium atom (D) at the α-carbon position, which is the carbon atom adjacent to the carboxylic acid group. This deuterium substitution can affect the compound's physical and chemical properties, such as its reactivity, stability, and spectroscopic behavior. α-Deuterio-3-phenylpropionic acid is primarily used in scientific research and chemical analysis, particularly in studies involving isotope labeling and kinetic isotope effects. It can also be employed as a building block for the synthesis of more complex deuterated molecules and pharmaceuticals.

85020-80-0

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85020-80-0 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 85020-80-0 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 8,5,0,2 and 0 respectively; the second part has 2 digits, 8 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 85020-80:
(7*8)+(6*5)+(5*0)+(4*2)+(3*0)+(2*8)+(1*0)=110
110 % 10 = 0
So 85020-80-0 is a valid CAS Registry Number.

85020-80-0Downstream Products

85020-80-0Relevant academic research and scientific papers

Reversal of Enantioselectivity in the Hydroformylation of Styrene with [2S,4S-BDPP]Pt(SnCl3)Cl at High Temperature Arises from a Change in the Enantioselective-Determining Step

Casey, Charles P.,Martins, Susie C.,Fagan, Maureen A.

, p. 5585 - 5592 (2004)

Deuterioformylation of styrene catalyzed by [(2S,4S)-BDPP]Pt(SnCl 3)Cl at 39 °C gave 3-phenylpropanal (3) and 2-phenylpropanal (2) (n:i = 1.8, 71% ee (S)-2) with deuterium only β to the aldehyde carbonyl and in the formyl group. Small amounts o

Rhodium(I)-catalyzed 1,4-addition of arylboronic acids to acrylic acid in water: One-step preparation of 3-arylpropionic acids

Vautravers, Nicolas R.,Breit, Bernhard

supporting information; experimental part, p. 2517 - 2520 (2011/11/12)

A practical method for the one-step preparation of 3-arylpropionic acids through rhodium-catalyzed 1,4-addition of arylboronic acids to acrylic acid is reported. The method is applicable to a broad scope of aryl boronic acids and displays a wide functional group tolerance operating in water as the optimal reaction medium. Georg Thieme Verlag Stuttgart · New York.

Isomerisation reaction of a gem-bis-trifluoromethyl olefin in a basic medium: A kinetic study

Tordeux, Marc,Marival-Hodebar, Laurence,Pouet, Marie-Josée,Halle, Jean-Claude,Wakselman, Claude

, p. 147 - 152 (2007/10/03)

The rearrangement of 5-phenyl-1,1,1-trifluoro-2-(trifluoromethyl)pent-2-ene to 5-phenyl-1,1,1-trifluoro-2-(trifluoromethyl)pent-3-ene has been studied by 19F NMR in dimethylsulphoxide (DMSO). This isomerisation is catalysed by a base such as tr

COBALT-CATALYZED CARBONYLATION OF OPTICALLY ACTIVE AND α-DEUTERATED PHENETHYL HALIDES

Francalanci, F.,Gardano, A.,Abis, L.,Fiorani, T.,Foa, M.

, p. 87 - 94 (2007/10/02)

Carbonylation of optically active α-phenethyl halides under phase transfer conditions gives hydratropic acid of the opposite absolute configuration.The inversion of configuration is accompanied by extensive racemization.The latter appears to originate from equilibria between keto and enol forms of acylcobalt-carbonyl complexes and between branched and linear alkyl complexes.Double carbonylation of α-phenethyl bromide is strongly inhibited when the benzylic hydrogen is replaced by deuterium.This large isotope effect provides the first experimental support for the proposed intermediacy of an enolic species in the double carbon monoxide insertion.

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