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Home > Imidazoles > 89839-09-8
89839-09-8 | Undecanoic acid, 11-[(1,4,5-triphenyl-1H-imidazol-2-yl)oxy]-
CAS No: 89839-09-8 Catalog No: AG0086DX MDL No:
Product Description
Catalog Number:
AG0086DX
Chemical Name:
Undecanoic acid, 11-[(1,4,5-triphenyl-1H-imidazol-2-yl)oxy]-
CAS Number:
89839-09-8
Molecular Formula:
C32H36N2O3
Molecular Weight:
496.6398
IUPAC Name:
11-(1,4,5-triphenylimidazol-2-yl)oxyundecanoic acid
InChI:
InChI=1S/C32H36N2O3/c35-29(36)24-16-5-3-1-2-4-6-17-25-37-32-33-30(26-18-10-7-11-19-26)31(27-20-12-8-13-21-27)34(32)28-22-14-9-15-23-28/h7-15,18-23H,1-6,16-17,24-25H2,(H,35,36)
InChI Key:
AURRKGGYZZOUHD-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCCCCCCOc1nc(c(n1c1ccccc1)c1ccccc1)c1ccccc1
Properties
Complexity:
626
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
496.273g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
496.651g/mol
Monoisotopic Mass:
496.273g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.6
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