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Home > Nitro Compounds > 16264-08-7
16264-08-7 | Ethanone, 1-[4-(4-nitrophenyl)-1-piperazinyl]-
CAS No: 16264-08-7 Catalog No: AG001TAG MDL No:MFCD00248261
Product Description
Catalog Number:
AG001TAG
Chemical Name:
Ethanone, 1-[4-(4-nitrophenyl)-1-piperazinyl]-
CAS Number:
16264-08-7
Molecular Formula:
C12H15N3O3
Molecular Weight:
249.2658
MDL Number:
MFCD00248261
IUPAC Name:
1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone
InChI:
InChI=1S/C12H15N3O3/c1-10(16)13-6-8-14(9-7-13)11-2-4-12(5-3-11)15(17)18/h2-5H,6-9H2,1H3
InChI Key:
QUZMCJMGHMRZHA-UHFFFAOYSA-N
SMILES:
CC(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.111g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.27g/mol
Monoisotopic Mass:
249.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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