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Home > Nitro Compounds > 249604-79-3
249604-79-3 | 3-HYDROXY-5-NITROQUINOLIN-2(1H)-ONE
CAS No: 249604-79-3 Catalog No: AG01DMLD MDL No:
Product Description
Catalog Number:
AG01DMLD
Chemical Name:
3-HYDROXY-5-NITROQUINOLIN-2(1H)-ONE
CAS Number:
249604-79-3
IUPAC Name:
3-hydroxy-5-nitro-1H-quinolin-2-one
InChI:
InChI=1S/C9H6N2O4/c12-8-4-5-6(10-9(8)13)2-1-3-7(5)11(14)15/h1-4,12H,(H,10,13)
InChI Key:
VACOSOSITAZPCX-UHFFFAOYSA-N
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.033g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.157g/mol
Monoisotopic Mass:
206.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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