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16872-50-7

16872-50-7 | 1-Imidazolidinecarboxamide, N-methyl-3-nitroso-2-oxo-

CAS No: 16872-50-7 Catalog No: AG001Y8T MDL No:

Product Description

Catalog Number:
AG001Y8T
Chemical Name:
1-Imidazolidinecarboxamide, N-methyl-3-nitroso-2-oxo-
CAS Number:
16872-50-7
Molecular Formula:
C5H8N4O3
Molecular Weight:
172.1420
IUPAC Name:
N-methyl-3-nitroso-2-oxoimidazolidine-1-carboxamide
InChI:
InChI=1S/C5H8N4O3/c1-6-4(10)8-2-3-9(7-12)5(8)11/h2-3H2,1H3,(H,6,10)
InChI Key:
TUDNLYBYRMSGTF-UHFFFAOYSA-N
SMILES:
CNC(=O)N1CCN(C1=O)N=O
NSC Number:
95445

Properties

Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.06g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.144g/mol
Monoisotopic Mass:
172.06g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  

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