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Alanine, N-benzoyl-3,3,3-trifluoro-, also known as N-benzoyl-3,3,3-trifluoroalanine, is a synthetic chemical compound with the molecular formula C10H8F3NO3. It is a derivative of the naturally occurring amino acid alanine, where the hydrogen atoms on the alpha-carbon are replaced by fluorine atoms, and the amino group is acylated with a benzoyl group. Alanine, N-benzoyl-3,3,3-trifluoro- is of interest in the field of organic chemistry and medicinal chemistry, as it can be used as a building block for the synthesis of more complex molecules or as a probe to study the effects of fluorination on the properties and reactivity of amino acids. The trifluoromethyl group can significantly alter the physical and chemical properties of the molecule, such as increasing its lipophilicity and potentially affecting its metabolic stability.

1465-42-5

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1465-42-5 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 1465-42-5 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 1,4,6 and 5 respectively; the second part has 2 digits, 4 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 1465-42:
(6*1)+(5*4)+(4*6)+(3*5)+(2*4)+(1*2)=75
75 % 10 = 5
So 1465-42-5 is a valid CAS Registry Number.

1465-42-5SDS

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 (2R)-2-benzamido-3,3,3-trifluoropropanoic acid

1.2 Other means of identification

Product number -
Other names 2-benzoylamino-3,3,3-trifluoro-propionic 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:1465-42-5 SDS

1465-42-5Relevant academic research and scientific papers

Design of radical-resistant amino acid residues: A combined theoretical and experimental investigation

Croft, Anna K.,Easton, Christopher J.,Radom, Leo

, p. 4119 - 4124 (2007/10/03)

Ab initio calculations have been used to design radical -resistant amino acid residues. Optimized structures of free and protected amino acids and their corresponding β-carbon-centered radicals were determined with B3-LYP/6-31G(d). Single-point RMP2/6-31G

New Synthetic Pathways to 3,3,3-Trifluoroalanine, 2-Deutero-3,3,3-trifluoroalanine and their Derivatives

Burger, Klaus,Hoess, Eva,Gaa, Karl,Sewald, Norbert,Schierlinger, Christian

, p. 361 - 384 (2007/10/02)

New synthetic pathways to 3,3,3-trifluoroalanine, 2-deutero-3,3,3-trifluoroalanine, their esters, amides, and thioamides are described, starting from hexafluoroacetone, and trifluoropyruvates, respectively.

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