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Home > Nitro Compounds > 1050884-58-6
1050884-58-6 | 5-methyl-N-(2-methyl-4-nitrophenyl)-1,2-oxazole-4-carboxamide
CAS No: 1050884-58-6 Catalog No: AG019M0C MDL No:MFCD09971676
Product Description
Catalog Number:
AG019M0C
Chemical Name:
5-methyl-N-(2-methyl-4-nitrophenyl)-1,2-oxazole-4-carboxamide
CAS Number:
1050884-58-6
Molecular Formula:
C12H11N3O4
Molecular Weight:
261.2334
MDL Number:
MFCD09971676
IUPAC Name:
5-methyl-N-(2-methyl-4-nitrophenyl)-1,2-oxazole-4-carboxamide
InChI:
InChI=1S/C12H11N3O4/c1-7-5-9(15(17)18)3-4-11(7)14-12(16)10-6-13-19-8(10)2/h3-6H,1-2H3,(H,14,16)
InChI Key:
LQTBHXULKJCGFT-UHFFFAOYSA-N
SMILES:
Cc1cc(ccc1NC(=O)c1cnoc1C)[N+](=O)[O-]
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.075g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.237g/mol
Monoisotopic Mass:
261.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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