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Home > Imidazoles > 121430-57-7
121430-57-7 | Phenol, 4,4'-(2-phenyl-1H-imidazole-4,5-diyl)bis-
CAS No: 121430-57-7 Catalog No: AG007Q88 MDL No:
Product Description
Catalog Number:
AG007Q88
Chemical Name:
Phenol, 4,4'-(2-phenyl-1H-imidazole-4,5-diyl)bis-
CAS Number:
121430-57-7
Molecular Formula:
C21H16N2O2
Molecular Weight:
328.3639
IUPAC Name:
4-[4-(4-hydroxyphenyl)-2-phenyl-1H-imidazol-5-yl]phenol
InChI:
InChI=1S/C21H16N2O2/c24-17-10-6-14(7-11-17)19-20(15-8-12-18(25)13-9-15)23-21(22-19)16-4-2-1-3-5-16/h1-13,24-25H,(H,22,23)
InChI Key:
GXASRDCGNMNBAU-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)O)c1ccccc1
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.121g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
328.371g/mol
Monoisotopic Mass:
328.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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