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827299-55-8 | Phenol, 3,5-dichloro-4-[5-(2-fluoro-4-hydroxyphenyl)-1H-imidazol-4-yl]-
CAS No: 827299-55-8 Catalog No: AG0050T0 MDL No:
Product Description
Catalog Number:
AG0050T0
Chemical Name:
Phenol, 3,5-dichloro-4-[5-(2-fluoro-4-hydroxyphenyl)-1H-imidazol-4-yl]-
CAS Number:
827299-55-8
Molecular Formula:
C15H9Cl2FN2O2
Molecular Weight:
339.1486
IUPAC Name:
3,5-dichloro-4-[4-(2-fluoro-4-hydroxyphenyl)-1H-imidazol-5-yl]phenol
InChI:
InChI=1S/C15H9Cl2FN2O2/c16-10-3-8(22)4-11(17)13(10)15-14(19-6-20-15)9-2-1-7(21)5-12(9)18/h1-6,21-22H,(H,19,20)
InChI Key:
BKFAJIHSEZANJZ-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)F)c1[nH]cnc1c1c(Cl)cc(cc1Cl)O
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.003g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
339.147g/mol
Monoisotopic Mass:
338.003g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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