Chloroacetyl Chloride-13C2


Chemical Name: Chloroacetyl Chloride-13C2
CAS Number: 286367-76-8
Product Number: AG00BO4G(AGN-PC-0WP1CR)
Synonyms:
MDL No:
Molecular Formula:
Molecular Weight:

Identification/Properties


Computed Properties
Molecular Weight:
114.922g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
113.955g/mol
Monoisotopic Mass:
113.955g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
5
Formal Charge:
0
Complexity:
42.9
Isotope Atom Count:
2
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



Chloroacetyl Chloride-13C2 is a unique isotope-labeled reagent that serves as a versatile tool in chemical synthesis. Its application lies in the field of isotope labeling, which is crucial in the study of reaction mechanisms, molecular structures, and metabolic pathways. By incorporating the 13C isotope into chloroacetyl chloride, researchers can track the fate of this molecule in complex chemical reactions with enhanced precision and sensitivity. This labeled compound finds extensive use in the synthesis of pharmaceuticals, agrochemicals, and other fine chemicals where isotopic labeling is essential for elucidating reaction pathways and understanding molecular transformations. Its high purity and reliable performance make it a valuable resource for chemists and researchers looking to enhance their understanding of organic reactions at the molecular level.