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Home > Imidazoles > 78465-92-6
78465-92-6 | 1H-Benzimidazolium, 1,3-dimethyl-2-(phenylmethyl)-, iodide
CAS No: 78465-92-6 Catalog No: AG008MLW MDL No:
Product Description
Catalog Number:
AG008MLW
Chemical Name:
1H-Benzimidazolium, 1,3-dimethyl-2-(phenylmethyl)-, iodide
CAS Number:
78465-92-6
Molecular Formula:
C16H19IN2
Molecular Weight:
366.2399
IUPAC Name:
2-benzyl-1,3-dimethyl-1,2-dihydrobenzimidazol-1-ium;iodide
InChI:
InChI=1S/C16H18N2.HI/c1-17-14-10-6-7-11-15(14)18(2)16(17)12-13-8-4-3-5-9-13;/h3-11,16H,12H2,1-2H3;1H
InChI Key:
DTMSIXROGHTURW-UHFFFAOYSA-N
SMILES:
C[NH+]1c2ccccc2N(C1Cc1ccccc1)C.[I-]
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.059g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
366.246g/mol
Monoisotopic Mass:
366.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
7.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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