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Home > Imidazoles > 455270-59-4
455270-59-4 | 1-Hexyl-2,3-dimethyl-1H-imidazol-3-ium chloride
CAS No: 455270-59-4 Catalog No: AG006ZIT MDL No:
Product Description
Catalog Number:
AG006ZIT
Chemical Name:
1-Hexyl-2,3-dimethyl-1H-imidazol-3-ium chloride
CAS Number:
455270-59-4
Molecular Formula:
C11H21ClN2
Molecular Weight:
216.7508
IUPAC Name:
1-hexyl-2,3-dimethylimidazol-3-ium;chloride
InChI:
InChI=1S/C11H21N2.ClH/c1-4-5-6-7-8-13-10-9-12(3)11(13)2;/h9-10H,4-8H2,1-3H3;1H/q+1;/p-1
InChI Key:
NCTQEXWJEPRHLV-UHFFFAOYSA-M
SMILES:
CCCCCCn1cc[n+](c1C)C.[Cl-]
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.139g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.753g/mol
Monoisotopic Mass:
216.139g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
8.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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