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Home > Imidazoles > 161328-92-3
161328-92-3 | 1H-Imidazolium, 2-[2-(4-methoxyphenyl)diazenyl]-1,3-dimethyl-, chloride (1:1)
CAS No: 161328-92-3 Catalog No: AG001SD4 MDL No:
Product Description
Catalog Number:
AG001SD4
Chemical Name:
1H-Imidazolium, 2-[2-(4-methoxyphenyl)diazenyl]-1,3-dimethyl-, chloride (1:1)
CAS Number:
161328-92-3
Molecular Formula:
C12H17ClN4O
Molecular Weight:
268.7426
IUPAC Name:
(1,3-dimethyl-1,2-dihydroimidazol-1-ium-2-yl)-(4-methoxyphenyl)diazene;chloride
InChI:
InChI=1S/C12H16N4O.ClH/c1-15-8-9-16(2)12(15)14-13-10-4-6-11(17-3)7-5-10;/h4-9,12H,1-3H3;1H
InChI Key:
OOWQKSNWJNMCPZ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)N=NC1N(C)C=C[NH+]1C.[Cl-]
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.109g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
268.745g/mol
Monoisotopic Mass:
268.109g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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