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Home > Imidazoles > 851488-82-9
851488-82-9 | 1H-Imidazolium, 1,1'-methylenebis[3-methyl-, dichloride
CAS No: 851488-82-9 Catalog No: AG004N6K MDL No:
Product Description
Catalog Number:
AG004N6K
Chemical Name:
1H-Imidazolium, 1,1'-methylenebis[3-methyl-, dichloride
CAS Number:
851488-82-9
Molecular Formula:
C9H18Cl2N4
Molecular Weight:
253.1720
IUPAC Name:
3-methyl-1-[(3-methyl-1,2-dihydroimidazol-1-ium-1-yl)methyl]-1,2-dihydroimidazol-1-ium;dichloride
InChI:
InChI=1S/C9H16N4.2ClH/c1-10-3-5-12(7-10)9-13-6-4-11(2)8-13;;/h3-6H,7-9H2,1-2H3;2*1H
InChI Key:
JRAZASNMEHYGED-UHFFFAOYSA-N
SMILES:
CN1C=C[NH+](C1)C[NH+]1C=CN(C1)C.[Cl-].[Cl-]
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.091g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
253.171g/mol
Monoisotopic Mass:
252.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
15.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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