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159662-81-4 | 1-Methyl-3-phenylpyridinium hexafluorophosphate
CAS No: 159662-81-4 Catalog No: AG01EU9W MDL No:
Product Description
Catalog Number:
AG01EU9W
Chemical Name:
1-Methyl-3-phenylpyridinium hexafluorophosphate
CAS Number:
159662-81-4
Molecular Formula:
C12H12F6NP
Molecular Weight:
315.1946
IUPAC Name:
1-methyl-3-phenylpyridin-1-ium;hexafluorophosphate
InChI:
InChI=1S/C12H12N.F6P/c1-13-9-5-8-12(10-13)11-6-3-2-4-7-11;1-7(2,3,4,5)6/h2-10H,1H3;/q+1;-1
InChI Key:
HLFLSAXKKNRTLO-UHFFFAOYSA-N
SMILES:
F[P-](F)(F)(F)(F)F.C[n+]1cccc(c1)c1ccccc1
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.061g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.199g/mol
Monoisotopic Mass:
315.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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