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122775-19-3

122775-19-3 | 2-Propenamide-2,3,3-d3 (9CI)

CAS No: 122775-19-3 Catalog No: AG000JG1 MDL No:

Product Description

Catalog Number:
AG000JG1
Chemical Name:
2-Propenamide-2,3,3-d3 (9CI)
CAS Number:
122775-19-3
Molecular Formula:
C3H2D3NO
Molecular Weight:
74.0964
IUPAC Name:
2,3,3-trideuterioprop-2-enamide
InChI:
InChI=1S/C3H5NO/c1-2-3(4)5/h2H,1H2,(H2,4,5)/i1D2,2D
InChI Key:
HRPVXLWXLXDGHG-FUDHJZNOSA-N
SMILES:
C(=C(C(=O)N)[2H])([2H])[2H]

Properties

Complexity:
57.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
74.056g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
3  
Molecular Weight:
74.097g/mol
Monoisotopic Mass:
74.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  

Literature

Title Journal
Analysis of acrylamide in water using a coevaporation preparative step and isotope dilution liquid chromatography tandem mass spectrometry. Analytical chemistry 20070701

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