Synonyms
1,4-Dimethyl-4H-1,2,4-triazolium iodide
IUPAC Name
1,4-dimethyl-1,2,4-triazol-4-ium;iodide
Molecular Weight
225.03
Molecular Formula
C4H8IN3
Canonical SMILES
CN1C=[N+](C=N1)C.[I-];
InChI
IMFBMMNQDMTHGG-UHFFFAOYSA-M
InChI Key
InChI=1S/C4H8N3.HI/c1-6-3-5-7(2)4-6;/h3-4H,1-2H3;1H/q+1;/p-1
Melting Point
120-125 °C
Purity
97%
Appearance
Solid
Complexity
64
Covalently-Bonded Unit Count
2
Exact Mass
224.976g/mol
H-Bond Acceptor
2
Heavy Atom Count
8
Isomeric SMILES
CN1C=[N+](C=N1)C.[I-]
Monoisotopic Mass
224.976g/mol
Topological Polar Surface Area
21.7A^2
