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1175-65-1 | Pyridinium, 1-methyl-2,4,6-triphenyl-, perchlorate (1:1)
CAS No: 1175-65-1 Catalog No: AG000EDG MDL No:
Product Description
Catalog Number:
AG000EDG
Chemical Name:
Pyridinium, 1-methyl-2,4,6-triphenyl-, perchlorate (1:1)
CAS Number:
1175-65-1
Molecular Formula:
C24H20ClNO4
Molecular Weight:
421.8729
IUPAC Name:
1-methyl-2,4,6-triphenylpyridin-1-ium;perchlorate
InChI:
InChI=1S/C24H20N.ClHO4/c1-25-23(20-13-7-3-8-14-20)17-22(19-11-5-2-6-12-19)18-24(25)21-15-9-4-10-16-21;2-1(3,4)5/h2-18H,1H3;(H,2,3,4,5)/q+1;/p-1
InChI Key:
JKMOQCAEOVGBFN-UHFFFAOYSA-M
SMILES:
[O-][Cl](=O)(=O)=O.C[n+]1c(cc(cc1c1ccccc1)c1ccccc1)c1ccccc1
Properties
Complexity:
455
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
421.108g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
421.877g/mol
Monoisotopic Mass:
421.108g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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