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1020719-64-5

1020719-64-5 | Propanamide-3,3,3-d3, 2-(methyl-d3)-

CAS No: 1020719-64-5 Catalog No: AG0006KD MDL No:

Product Description

Catalog Number:
AG0006KD
Chemical Name:
Propanamide-3,3,3-d3, 2-(methyl-d3)-
CAS Number:
1020719-64-5
Molecular Formula:
C4H3D6NO
Molecular Weight:
93.1573
IUPAC Name:
3,3,3-trideuterio-2-(trideuteriomethyl)propanamide
InChI:
InChI=1S/C4H9NO/c1-3(2)4(5)6/h3H,1-2H3,(H2,5,6)/i1D3,2D3
InChI Key:
WFKAJVHLWXSISD-WFGJKAKNSA-N
SMILES:
C([2H])(C(C([2H])([2H])[2H])C(=O)N)([2H])[2H]

Properties

Complexity:
58.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
93.106g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
6  
Molecular Weight:
93.159g/mol
Monoisotopic Mass:
93.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  

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