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63512-52-7 | 1-ethyl-4-(phenylthio)pyridinium iodide
CAS No: 63512-52-7 Catalog No: AG00EU7A MDL No:
Product Description
Catalog Number:
AG00EU7A
Chemical Name:
1-ethyl-4-(phenylthio)pyridinium iodide
CAS Number:
63512-52-7
IUPAC Name:
1-ethyl-4-phenylsulfanylpyridin-1-ium;iodide
InChI:
InChI=1S/C13H14NS.HI/c1-2-14-10-8-13(9-11-14)15-12-6-4-3-5-7-12;/h3-11H,2H2,1H3;1H/q+1;/p-1
InChI Key:
KDAYPDWBPIWATK-UHFFFAOYSA-M
EC Number:
264-285-5
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.989g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.226g/mol
Monoisotopic Mass:
342.989g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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