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Home > Nitro Compounds > 400088-76-8
400088-76-8 | 1-(5-nitropyridin-2-yl)-4-phenylpiperazine
CAS No: 400088-76-8 Catalog No: AG00IRBN MDL No:MFCD01308982
Product Description
Catalog Number:
AG00IRBN
Chemical Name:
1-(5-nitropyridin-2-yl)-4-phenylpiperazine
CAS Number:
400088-76-8
Molecular Formula:
C15H16N4O2
Molecular Weight:
284.3131
MDL Number:
MFCD01308982
IUPAC Name:
1-(5-nitropyridin-2-yl)-4-phenylpiperazine
InChI:
InChI=1S/C15H16N4O2/c20-19(21)14-6-7-15(16-12-14)18-10-8-17(9-11-18)13-4-2-1-3-5-13/h1-7,12H,8-11H2
InChI Key:
TWDYOWBTLDZFJA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(nc1)N1CCN(CC1)c1ccccc1
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.127g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.319g/mol
Monoisotopic Mass:
284.127g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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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