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Home > Nitro Compounds > 821767-56-0
821767-56-0 | Methanone, 1H-indazol-3-yl(2-nitrophenyl)-
CAS No: 821767-56-0 Catalog No: AG0059WD MDL No:
Product Description
Catalog Number:
AG0059WD
Chemical Name:
Methanone, 1H-indazol-3-yl(2-nitrophenyl)-
CAS Number:
821767-56-0
Molecular Formula:
C14H9N3O3
Molecular Weight:
267.2396
IUPAC Name:
1H-indazol-3-yl-(2-nitrophenyl)methanone
InChI:
InChI=1S/C14H9N3O3/c18-14(10-6-2-4-8-12(10)17(19)20)13-9-5-1-3-7-11(9)15-16-13/h1-8H,(H,15,16)
InChI Key:
ZQFVIYZUGUFOMX-UHFFFAOYSA-N
SMILES:
O=C(c1n[nH]c2c1cccc2)c1ccccc1[N+](=O)[O-]
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.064g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.244g/mol
Monoisotopic Mass:
267.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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