Home Nitros 1-(difluoromethyl)-3-nitro-1H-indazole

1-(difluoromethyl)-3-nitro-1H-indazole

CAS No.:
1803599-67-8
Catalog Number:
AG01BF8Q
Molecular Formula:
C8H5F2N3O2
Molecular Weight:
213.1410
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Product Description
Catalog Number:
AG01BF8Q
Chemical Name:
1-(difluoromethyl)-3-nitro-1H-indazole
CAS Number:
1803599-67-8
Molecular Formula:
C8H5F2N3O2
Molecular Weight:
213.1410
MDL Number:
MFCD28118529
IUPAC Name:
1-(difluoromethyl)-3-nitroindazole
InChI:
InChI=1S/C8H5F2N3O2/c9-8(10)12-6-4-2-1-3-5(6)7(11-12)13(14)15/h1-4,8H
InChI Key:
NZUPIISPQRTEQZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1nn(c2c1cccc2)C(F)F
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.144g/mol
Monoisotopic Mass:
213.035g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties