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101420-98-8 | 1H-Indazole, 6-chloro-5-nitro-
CAS No: 101420-98-8 Catalog No: AG0004GX MDL No:MFCD08690109
Product Description
Catalog Number:
AG0004GX
Chemical Name:
1H-Indazole, 6-chloro-5-nitro-
CAS Number:
101420-98-8
Molecular Formula:
C7H4ClN3O2
Molecular Weight:
197.5786
MDL Number:
MFCD08690109
IUPAC Name:
6-chloro-5-nitro-1H-indazole
InChI:
InChI=1S/C7H4ClN3O2/c8-5-2-6-4(3-9-10-6)1-7(5)11(12)13/h1-3H,(H,9,10)
InChI Key:
SXVCMKGCWGVSSX-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2cn[nH]c2cc1Cl
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.999g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.578g/mol
Monoisotopic Mass:
196.999g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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