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Home > Nitro Compounds > 147849-76-1
147849-76-1 | 3(2H)-Pyridazinone, 6-(2-nitrophenyl)-
CAS No: 147849-76-1 Catalog No: AG01FN10 MDL No:MFCD12143100
Product Description
Catalog Number:
AG01FN10
Chemical Name:
3(2H)-Pyridazinone, 6-(2-nitrophenyl)-
CAS Number:
147849-76-1
Molecular Formula:
C10H7N3O3
Molecular Weight:
217.1809
MDL Number:
MFCD12143100
IUPAC Name:
3-(2-nitrophenyl)-1H-pyridazin-6-one
InChI:
InChI=1S/C10H7N3O3/c14-10-6-5-8(11-12-10)7-3-1-2-4-9(7)13(15)16/h1-6H,(H,12,14)
InChI Key:
PPOOKRDNXQWOFM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1c1ccc(=O)[nH]n1
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.049g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.184g/mol
Monoisotopic Mass:
217.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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