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142715-08-0 | 1H-Imidazole, 4,4'-methylenebis[5-ethyl-2-undecyl-
CAS No: 142715-08-0 Catalog No: AG006XY4 MDL No:
Product Description
Catalog Number:
AG006XY4
Chemical Name:
1H-Imidazole, 4,4'-methylenebis[5-ethyl-2-undecyl-
CAS Number:
142715-08-0
Molecular Formula:
C33H60N4
Molecular Weight:
512.8563
IUPAC Name:
4-ethyl-5-[(4-ethyl-2-undecyl-1H-imidazol-5-yl)methyl]-2-undecyl-1H-imidazole
InChI:
InChI=1S/C33H60N4/c1-5-9-11-13-15-17-19-21-23-25-32-34-28(7-3)30(36-32)27-31-29(8-4)35-33(37-31)26-24-22-20-18-16-14-12-10-6-2/h5-27H2,1-4H3,(H,34,36)(H,35,37)
InChI Key:
HFIGMRMJLIHODT-UHFFFAOYSA-N
SMILES:
CCc1[nH]c(nc1Cc1nc([nH]c1CC)CCCCCCCCCCC)CCCCCCCCCCC
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
512.482g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
512.871g/mol
Monoisotopic Mass:
512.482g/mol
Rotatable Bond Count:
24
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
12.9
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