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Home > Nitro Compounds > 90059-73-7
90059-73-7 | 1H-Indazole, 1-(1-methyl-1H-tetrazol-5-yl)-4,6-dinitro-
CAS No: 90059-73-7 Catalog No: AG00H8S8 MDL No:
Product Description
Catalog Number:
AG00H8S8
Chemical Name:
1H-Indazole, 1-(1-methyl-1H-tetrazol-5-yl)-4,6-dinitro-
CAS Number:
90059-73-7
Molecular Formula:
C9H6N8O4
Molecular Weight:
290.1951
IUPAC Name:
1-(1-methyltetrazol-5-yl)-4,6-dinitroindazole
InChI:
InChI=1S/C9H6N8O4/c1-14-9(11-12-13-14)15-7-2-5(16(18)19)3-8(17(20)21)6(7)4-10-15/h2-4H,1H3
InChI Key:
UWESETJITIWNTL-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2n(ncc2c(c1)[N+](=O)[O-])c1nnnn1C
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.051g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.199g/mol
Monoisotopic Mass:
290.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
153A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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