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Home > Nitro Compounds > 1260386-34-2
1260386-34-2 | 1H-Indazole-3-carbonitrile, 4-nitro-
CAS No: 1260386-34-2 Catalog No: AG000QTJ MDL No:MFCD16876042
Product Description
Catalog Number:
AG000QTJ
Chemical Name:
1H-Indazole-3-carbonitrile, 4-nitro-
CAS Number:
1260386-34-2
Molecular Formula:
C8H4N4O2
Molecular Weight:
188.1430
MDL Number:
MFCD16876042
IUPAC Name:
4-nitro-1H-indazole-3-carbonitrile
InChI:
InChI=1S/C8H4N4O2/c9-4-6-8-5(10-11-6)2-1-3-7(8)12(13)14/h1-3H,(H,10,11)
InChI Key:
HZHFZCRAUODOEG-UHFFFAOYSA-N
SMILES:
N#Cc1n[nH]c2c1c(ccc2)[N+](=O)[O-]
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.033g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.146g/mol
Monoisotopic Mass:
188.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
98.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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