1,2-Ethane-1,1,2,2-d4-diol-d2


Chemical Name: 1,2-Ethane-1,1,2,2-d4-diol-d2
CAS Number: 15054-86-1
Product Number: AG001MPR(AGN-PC-0Q4VFV)
Synonyms:
MDL No:
Molecular Formula: C2D6O2
Molecular Weight: 68.1048

Identification/Properties


Properties
MP:
−13℃ (lit.)
Storage:
Room Temperature;Keep in dry area;
Form:
Liquid
Computed Properties
Molecular Weight:
68.105g/mol
XLogP3:
-1.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
68.074g/mol
Monoisotopic Mass:
68.074g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
4
Formal Charge:
0
Complexity:
6
Isotope Atom Count:
6
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



In chemical synthesis, 1,2-Ethane-1,1,2,2-d4-diol-d2 plays a crucial role as a labeled derivative of ethylene glycol. Its unique isotopic composition makes it an invaluable tool in various analytical and research applications. This compound is commonly used as a tracer in studies involving reaction mechanisms, kinetics, and metabolic pathways. By incorporating 1,2-Ethane-1,1,2,2-d4-diol-d2 into chemical reactions, researchers can track the movement of specific atoms and gain insights into complex molecular transformations. Additionally, its stable isotopic nature ensures accurate quantification and characterization of reaction products, making it an essential component in the arsenal of advanced analytical techniques.