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Home > Imidazoles > 142754-85-6
142754-85-6 | 1H-Imidazole-1-carboxamide, 2-methyl-N-(nitrophenyl)-
CAS No: 142754-85-6 Catalog No: AG007ZAT MDL No:
Product Description
Catalog Number:
AG007ZAT
Chemical Name:
1H-Imidazole-1-carboxamide, 2-methyl-N-(nitrophenyl)-
CAS Number:
142754-85-6
Molecular Formula:
C11H10N4O3
Molecular Weight:
246.2221
IUPAC Name:
2-methyl-N-(2-nitrophenyl)imidazole-1-carboxamide
InChI:
InChI=1S/C11H10N4O3/c1-8-12-6-7-14(8)11(16)13-9-4-2-3-5-10(9)15(17)18/h2-7H,1H3,(H,13,16)
InChI Key:
RULJOHQYGPRTKN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1NC(=O)n1ccnc1C
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.075g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.226g/mol
Monoisotopic Mass:
246.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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