Home Nitros 1-(difluoromethyl)-6-nitro-1H-indole

1-(difluoromethyl)-6-nitro-1H-indole

CAS No.:
1878839-79-2
Catalog Number:
AG01B4Z5
Molecular Formula:
C9H6F2N2O2
Molecular Weight:
212.1529
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Product Description
Catalog Number:
AG01B4Z5
Chemical Name:
1-(difluoromethyl)-6-nitro-1H-indole
CAS Number:
1878839-79-2
Molecular Formula:
C9H6F2N2O2
Molecular Weight:
212.1529
MDL Number:
MFCD29991850
IUPAC Name:
1-(difluoromethyl)-6-nitroindole
InChI:
InChI=1S/C9H6F2N2O2/c10-9(11)12-4-3-6-1-2-7(13(14)15)5-8(6)12/h1-5,9H
InChI Key:
KYHOLIHSLYTMSU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)n(cc2)C(F)F
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.04g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.156g/mol
Monoisotopic Mass:
212.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties