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Home > Pyridines > 460047-07-8
460047-07-8 | 1-(2,2-Dimethoxyethyl)-2,4,6-triphenylpyridin-1-ium perchlorate
CAS No: 460047-07-8 Catalog No: AG01EW2P MDL No:
Product Description
Catalog Number:
AG01EW2P
Chemical Name:
1-(2,2-Dimethoxyethyl)-2,4,6-triphenylpyridin-1-ium perchlorate
CAS Number:
460047-07-8
Molecular Formula:
C27H26ClNO6
Molecular Weight:
495.9514
IUPAC Name:
1-(2,2-dimethoxyethyl)-2,4,6-triphenylpyridin-1-ium;perchlorate
InChI:
InChI=1S/C27H26NO2.ClHO4/c1-29-27(30-2)20-28-25(22-14-8-4-9-15-22)18-24(21-12-6-3-7-13-21)19-26(28)23-16-10-5-11-17-23;2-1(3,4)5/h3-19,27H,20H2,1-2H3;(H,2,3,4,5)/q+1;/p-1
InChI Key:
RNYVXJUMRGDSAN-UHFFFAOYSA-M
SMILES:
[O-][Cl](=O)(=O)=O.COC(C[n+]1c(cc(cc1c1ccccc1)c1ccccc1)c1ccccc1)OC
Properties
Complexity:
543
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
495.145g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
495.956g/mol
Monoisotopic Mass:
495.145g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
96.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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