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3-Oxo-2-phenylbutanoic acid, also known as alpha-phenylacetoacetic acid, is a white crystalline chemical compound with a molecular formula of C10H10O3 and a molar mass of 178.18 g/mol. It is commonly used as an intermediate in the synthesis of pharmaceuticals and other organic compounds, serving as an important building block in the production of various drugs, including antihistamines and analgesics.

4433-88-9

4433-88-9 Suppliers

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4433-88-9 Usage

Uses

Used in Pharmaceutical Industry:
3-Oxo-2-phenylbutanoic acid is used as a key intermediate in the synthesis of various pharmaceuticals for its role in the production of antihistamines and analgesics. Its presence in the synthesis process contributes to the development of effective medications for treating allergies and pain relief.
Used in Chemical Industry:
3-Oxo-2-phenylbutanoic acid is used as a precursor in the synthesis of chiral compounds, which are essential in the pharmaceutical and chemical industries. Its ability to form chiral compounds makes it a valuable molecule for creating enantiomerically pure substances, crucial for the development of drugs with specific biological activities.
Used in Heterocyclic Compound Synthesis:
3-Oxo-2-phenylbutanoic acid is used as a potential precursor in the synthesis of various types of heterocyclic compounds. Its involvement in the synthesis process allows for the creation of diverse heterocyclic structures, which have a wide range of applications in the fields of pharmaceuticals, agrochemicals, and materials science.

Check Digit Verification of cas no

The CAS Registry Mumber 4433-88-9 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,4,3 and 3 respectively; the second part has 2 digits, 8 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 4433-88:
(6*4)+(5*4)+(4*3)+(3*3)+(2*8)+(1*8)=89
89 % 10 = 9
So 4433-88-9 is a valid CAS Registry Number.

4433-88-9SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-phenylacetoacetic acid

1.2 Other means of identification

Product number -
Other names 3-oxo-2-phenylbutanoic acid

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:4433-88-9 SDS

4433-88-9Relevant academic research and scientific papers

Sterically Hindered Free Radicals. Part 20. EPR and ENDOR Spectroscopy of α-Carbonyl Radicals

Kubiak, Bernd,Lehnig, Manfred,Neumann, Wilhelm P.,Pentling, Ursula,Zarkadis, Antonios K.

, p. 1443 - 1447 (2007/10/02)

The hyperfine coupling constants and g values of 11 α-carbonyl radicals CR1R2(CRO) (1) and CR3(CN)(CRO) (2) (R = H, Me, Ph, α-Naph; R1, R2, R3 = H, CO2Et, Ph, 2,4-Me2Ph, Mes) have been determined by EPR and, partially, ENDOR spectroscopy.The g values lie between 2.0025 and 2.0051.Except for CH(CO2Et)(CMeO)-radical, the g values are smaller than expected because of the steric hindrance of the substituents R1, R2 and R3.The CRO group is twisted out of the nodal plane of the radical which diminishes the delocalisation of the unpaired electron over the carboxyl group.The proton splittings in the α-aryl substituents differ significantly from those found in CH2Ph-radical because of distortions.Proton splittings in benzoyl groups have been observed for the first time.