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Home > Nitro Compounds > 87394-48-7
87394-48-7 | 1-(3-Nitropyridin-2-yl)piperazine
CAS No: 87394-48-7 Catalog No: AG004JVA MDL No:MFCD05182227
Product Description
Catalog Number:
AG004JVA
Chemical Name:
1-(3-Nitropyridin-2-yl)piperazine
CAS Number:
87394-48-7
Molecular Formula:
C9H12N4O2
Molecular Weight:
208.2172
MDL Number:
MFCD05182227
IUPAC Name:
1-(3-nitropyridin-2-yl)piperazine
InChI:
InChI=1S/C9H12N4O2/c14-13(15)8-2-1-3-11-9(8)12-6-4-10-5-7-12/h1-3,10H,4-7H2
InChI Key:
HSAKGWZDXDRYTB-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccnc1N1CCNCC1
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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