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1368438-85-0 | Piperazine, 1-(3-chloro-5-nitro-2-pyridinyl)-
CAS No: 1368438-85-0 Catalog No: AG0012GO MDL No:
Product Description
Catalog Number:
AG0012GO
Chemical Name:
Piperazine, 1-(3-chloro-5-nitro-2-pyridinyl)-
CAS Number:
1368438-85-0
Molecular Formula:
C9H11ClN4O2
Molecular Weight:
242.6622
IUPAC Name:
1-(3-chloro-5-nitropyridin-2-yl)piperazine
InChI:
InChI=1S/C9H11ClN4O2/c10-8-5-7(14(15)16)6-12-9(8)13-3-1-11-2-4-13/h5-6,11H,1-4H2
InChI Key:
HPFXUNSJCYQVBD-UHFFFAOYSA-N
SMILES:
Clc1cc(cnc1N1CCNCC1)[N+](=O)[O-]
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.057g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.663g/mol
Monoisotopic Mass:
242.057g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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