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7276-58-6 | 1-Methyl-2-phenyl-3-dodecylbenzimidazolinium ferrocyanide
CAS No: 7276-58-6 Catalog No: AG00FTVZ MDL No:
Product Description
Catalog Number:
AG00FTVZ
Chemical Name:
1-Methyl-2-phenyl-3-dodecylbenzimidazolinium ferrocyanide
CAS Number:
7276-58-6
IUPAC Name:
1-dodecyl-3-methyl-2-phenylbenzimidazol-3-ium;iron(3+);hexacyanide
InChI:
InChI=1S/3C26H37N2.6CN.Fe/c3*1-3-4-5-6-7-8-9-10-11-17-22-28-25-21-16-15-20-24(25)27(2)26(28)23-18-13-12-14-19-23;6*1-2;/h3*12-16,18-21H,3-11,17,22H2,1-2H3;;;;;;;/q3*+1;6*-1;+3
InChI Key:
IXTGTIIYAKDZHU-UHFFFAOYSA-N
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
10
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1343.84g/mol
Formal Charge:
0
Heavy Atom Count:
97
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
1344.741g/mol
Monoisotopic Mass:
1343.84g/mol
Rotatable Bond Count:
36
Topological Polar Surface Area:
169A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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