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Home > Nitro Compounds > 858661-74-2
858661-74-2 | 6-Nitro-1H-indazole-3-carbonitrile
CAS No: 858661-74-2 Catalog No: AG01EF1A MDL No:
Product Description
Catalog Number:
AG01EF1A
Chemical Name:
6-Nitro-1H-indazole-3-carbonitrile
CAS Number:
858661-74-2
IUPAC Name:
6-nitro-1H-indazole-3-carbonitrile
InChI:
InChI=1S/C8H4N4O2/c9-4-8-6-2-1-5(12(13)14)3-7(6)10-11-8/h1-3H,(H,10,11)
InChI Key:
KWKRGSHECGSWLO-UHFFFAOYSA-N
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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