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Home > Nitro Compounds > 775288-71-6
775288-71-6 | 1-(6-Nitropyridin-3-yl)piperazine
CAS No: 775288-71-6 Catalog No: AG005H3D MDL No:MFCD09041112
Product Description
Catalog Number:
AG005H3D
Chemical Name:
1-(6-Nitropyridin-3-yl)piperazine
CAS Number:
775288-71-6
Molecular Formula:
C9H12N4O2
Molecular Weight:
208.2172
MDL Number:
MFCD09041112
IUPAC Name:
1-(6-nitropyridin-3-yl)piperazine
InChI:
InChI=1S/C9H12N4O2/c14-13(15)9-2-1-8(7-11-9)12-5-3-10-4-6-12/h1-2,7,10H,3-6H2
InChI Key:
UBCDLQPOKISIDX-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cn1)N1CCNCC1
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.096g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.221g/mol
Monoisotopic Mass:
208.096g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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