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918636-28-9 | 1H-Imidazole, 4,5-diphenyl-2-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
CAS No: 918636-28-9 Catalog No: AG006CVC MDL No:
Product Description
Catalog Number:
AG006CVC
Chemical Name:
1H-Imidazole, 4,5-diphenyl-2-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
CAS Number:
918636-28-9
Molecular Formula:
C24H26N2
Molecular Weight:
342.4766
IUPAC Name:
4,5-diphenyl-2-(2,6,6-trimethylcyclohexen-1-yl)-1H-imidazole
InChI:
InChI=1S/C24H26N2/c1-17-11-10-16-24(2,3)20(17)23-25-21(18-12-6-4-7-13-18)22(26-23)19-14-8-5-9-15-19/h4-9,12-15H,10-11,16H2,1-3H3,(H,25,26)
InChI Key:
DEJGMHMHVYLZJB-UHFFFAOYSA-N
SMILES:
CC1=C(c2nc(c([nH]2)c2ccccc2)c2ccccc2)C(CCC1)(C)C
Properties
Complexity:
508
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.21g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
342.486g/mol
Monoisotopic Mass:
342.21g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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