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73286-93-8 | 1-(4-Nitrophenyl)-2,4,6-triphenylpyridinium tetrafluoroborate
CAS No: 73286-93-8 Catalog No: AG01EX88 MDL No:
Product Description
Catalog Number:
AG01EX88
Chemical Name:
1-(4-Nitrophenyl)-2,4,6-triphenylpyridinium tetrafluoroborate
CAS Number:
73286-93-8
Molecular Formula:
C29H21BF4N2O2
Molecular Weight:
516.2939
IUPAC Name:
1-(4-nitrophenyl)-2,4,6-triphenylpyridin-1-ium;tetrafluoroborate
InChI:
InChI=1S/C29H21N2O2.BF4/c32-31(33)27-18-16-26(17-19-27)30-28(23-12-6-2-7-13-23)20-25(22-10-4-1-5-11-22)21-29(30)24-14-8-3-9-15-24;2-1(3,4)5/h1-21H;/q+1;-1
InChI Key:
SUSLOVFZABDXBV-UHFFFAOYSA-N
SMILES:
F[B-](F)(F)F.[O-][N+](=O)c1ccc(cc1)[n+]1c(cc(cc1c1ccccc1)c1ccccc1)c1ccccc1
Properties
Complexity:
599
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
516.163g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
516.303g/mol
Monoisotopic Mass:
516.163g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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