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Home > Pyridines > 125569-19-9
125569-19-9 | 1-Isopropylpyridinium perchlorate
CAS No: 125569-19-9 Catalog No: AG01ERAH MDL No:
Product Description
Catalog Number:
AG01ERAH
Chemical Name:
1-Isopropylpyridinium perchlorate
CAS Number:
125569-19-9
Molecular Formula:
C8H12ClNO4
Molecular Weight:
221.6382
IUPAC Name:
1-propan-2-ylpyridin-1-ium;perchlorate
InChI:
InChI=1S/C8H12N.ClHO4/c1-8(2)9-6-4-3-5-7-9;2-1(3,4)5/h3-8H,1-2H3;(H,2,3,4,5)/q+1;/p-1
InChI Key:
KITDFIVXAHDTDS-UHFFFAOYSA-M
SMILES:
[O-][Cl](=O)(=O)=O.CC([n+]1ccccc1)C
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.045g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.637g/mol
Monoisotopic Mass:
221.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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