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Home > Imidazoles > 68867-65-2
68867-65-2 | 2-heptadecyl-1-methyl-1H-benzimidazole methyl sulphate
CAS No: 68867-65-2 Catalog No: AG00FR7V MDL No:
Product Description
Catalog Number:
AG00FR7V
Chemical Name:
2-heptadecyl-1-methyl-1H-benzimidazole methyl sulphate
CAS Number:
68867-65-2
IUPAC Name:
2-heptadecyl-1-methylbenzimidazole;methyl hydrogen sulfate
InChI:
InChI=1S/C25H42N2.CH4O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-25-26-23-20-18-19-21-24(23)27(25)2;1-5-6(2,3)4/h18-21H,3-17,22H2,1-2H3;1H3,(H,2,3,4)
InChI Key:
XMDZJBIDPCECHF-UHFFFAOYSA-N
EC Number:
272-522-9
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
482.318g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
482.724g/mol
Monoisotopic Mass:
482.318g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
89.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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