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159662-80-3 | 3-Iodo-1-methylpyridin-1-ium perchlorate
CAS No: 159662-80-3 Catalog No: AG01FC3O MDL No:MFCD05742394
Product Description
Catalog Number:
AG01FC3O
Chemical Name:
3-Iodo-1-methylpyridin-1-ium perchlorate
CAS Number:
159662-80-3
Molecular Formula:
C6H7ClINO4
Molecular Weight:
319.4815
MDL Number:
MFCD05742394
IUPAC Name:
3-iodo-1-methylpyridin-1-ium;perchlorate
InChI:
InChI=1S/C6H7IN.ClHO4/c1-8-4-2-3-6(7)5-8;2-1(3,4)5/h2-5H,1H3;(H,2,3,4,5)/q+1;/p-1
InChI Key:
AOBUPIRFMREKKU-UHFFFAOYSA-M
SMILES:
[O-][Cl](=O)(=O)=O.C[n+]1cccc(c1)I
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.911g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.479g/mol
Monoisotopic Mass:
318.911g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
78.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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