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Home > Nitro Compounds > 1049872-93-6
1049872-93-6 | 5-methyl-N-(3-nitrophenyl)-1,2-oxazole-4-carboxamide
CAS No: 1049872-93-6 Catalog No: AG019LZG MDL No:MFCD09971657
Product Description
Catalog Number:
AG019LZG
Chemical Name:
5-methyl-N-(3-nitrophenyl)-1,2-oxazole-4-carboxamide
CAS Number:
1049872-93-6
Molecular Formula:
C11H9N3O4
Molecular Weight:
247.2069
MDL Number:
MFCD09971657
IUPAC Name:
5-methyl-N-(3-nitrophenyl)-1,2-oxazole-4-carboxamide
InChI:
InChI=1S/C11H9N3O4/c1-7-10(6-12-18-7)11(15)13-8-3-2-4-9(5-8)14(16)17/h2-6H,1H3,(H,13,15)
InChI Key:
KXPAHNHHCVICGF-UHFFFAOYSA-N
SMILES:
O=C(c1cnoc1C)Nc1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.059g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.21g/mol
Monoisotopic Mass:
247.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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