Home Nitriles 5-fluoro-4-formyl-2-nitrobenzonitrile

5-fluoro-4-formyl-2-nitrobenzonitrile

CAS No.:
1803590-78-4
Catalog Number:
AG01BEFI
Molecular Formula:
C8H3FN2O3
Molecular Weight:
194.1194
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Product Description
Catalog Number:
AG01BEFI
Chemical Name:
5-fluoro-4-formyl-2-nitrobenzonitrile
CAS Number:
1803590-78-4
Molecular Formula:
C8H3FN2O3
Molecular Weight:
194.1194
MDL Number:
MFCD28063999
IUPAC Name:
5-fluoro-4-formyl-2-nitrobenzonitrile
InChI:
InChI=1S/C8H3FN2O3/c9-7-1-5(3-10)8(11(13)14)2-6(7)4-12/h1-2,4H
InChI Key:
RXSZJISAUBWFMS-UHFFFAOYSA-N
SMILES:
O=Cc1cc([N+](=O)[O-])c(cc1F)C#N
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.013g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.121g/mol
Monoisotopic Mass:
194.013g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties