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Home > Nitro Compounds > 939699-56-6
939699-56-6 | 4-(5-nitropyridin-2-yl)piperazin-2-one
CAS No: 939699-56-6 Catalog No: AG00H29I MDL No:
Product Description
Catalog Number:
AG00H29I
Chemical Name:
4-(5-nitropyridin-2-yl)piperazin-2-one
CAS Number:
939699-56-6
IUPAC Name:
4-(5-nitropyridin-2-yl)piperazin-2-one
InChI:
InChI=1S/C9H10N4O3/c14-9-6-12(4-3-10-9)8-2-1-7(5-11-8)13(15)16/h1-2,5H,3-4,6H2,(H,10,14)
InChI Key:
PCCBBTRAESJVKS-UHFFFAOYSA-N
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.075g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.204g/mol
Monoisotopic Mass:
222.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
91A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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