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129993-50-6 | 1H-Imidazole-4-carboxamide, N,1-dimethyl-
CAS No: 129993-50-6 Catalog No: AG000TUG MDL No:MFCD12022308
Product Description
Catalog Number:
AG000TUG
Chemical Name:
1H-Imidazole-4-carboxamide, N,1-dimethyl-
CAS Number:
129993-50-6
Molecular Formula:
C6H9N3O
Molecular Weight:
139.1552
MDL Number:
MFCD12022308
IUPAC Name:
N,1-dimethylimidazole-4-carboxamide
InChI:
InChI=1S/C6H9N3O/c1-7-6(10)5-3-9(2)4-8-5/h3-4H,1-2H3,(H,7,10)
InChI Key:
VDIARKOFXBRNIY-UHFFFAOYSA-N
SMILES:
CNC(=O)c1ncn(c1)C
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.075g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.158g/mol
Monoisotopic Mass:
139.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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