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Home > Nitro Compounds > 830320-65-5
830320-65-5 | 1H-Indazole, 4-azido-6-nitro-1-phenyl-
CAS No: 830320-65-5 Catalog No: AG004YBF MDL No:
Product Description
Catalog Number:
AG004YBF
Chemical Name:
1H-Indazole, 4-azido-6-nitro-1-phenyl-
CAS Number:
830320-65-5
Molecular Formula:
C13H8N6O2
Molecular Weight:
280.2416
IUPAC Name:
4-azido-6-nitro-1-phenylindazole
InChI:
InChI=1S/C13H8N6O2/c14-17-16-12-6-10(19(20)21)7-13-11(12)8-15-18(13)9-4-2-1-3-5-9/h1-8H
InChI Key:
GZNYABSUHYCAPI-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1cc(cc2c1cnn2c1ccccc1)[N+](=O)[O-]
Properties
Complexity:
440
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.071g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.247g/mol
Monoisotopic Mass:
280.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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