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Home > Nitro Compounds > 941166-04-7
941166-04-7 | N-(4-nitrophenyl)-3-oxopiperazine-1-carboxamide
CAS No: 941166-04-7 Catalog No: AG019KTY MDL No:MFCD09403628
Product Description
Catalog Number:
AG019KTY
Chemical Name:
N-(4-nitrophenyl)-3-oxopiperazine-1-carboxamide
CAS Number:
941166-04-7
Molecular Formula:
C11H12N4O4
Molecular Weight:
264.2374
MDL Number:
MFCD09403628
IUPAC Name:
N-(4-nitrophenyl)-3-oxopiperazine-1-carboxamide
InChI:
InChI=1S/C11H12N4O4/c16-10-7-14(6-5-12-10)11(17)13-8-1-3-9(4-2-8)15(18)19/h1-4H,5-7H2,(H,12,16)(H,13,17)
InChI Key:
ZSWBQGORUFNNOY-UHFFFAOYSA-N
SMILES:
O=C1NCCN(C1)C(=O)Nc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.086g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.241g/mol
Monoisotopic Mass:
264.086g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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