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84011-93-8 | Oxazole, 2,2'-(2-fluoro-1,3-phenylene)bis[4,5-dihydro-4,4-dimethyl-
CAS No: 84011-93-8 Catalog No: AG004QFP MDL No:
Product Description
Catalog Number:
AG004QFP
Chemical Name:
Oxazole, 2,2'-(2-fluoro-1,3-phenylene)bis[4,5-dihydro-4,4-dimethyl-
CAS Number:
84011-93-8
Molecular Formula:
C16H19FN2O2
Molecular Weight:
290.3327
IUPAC Name:
2-[3-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-2-fluorophenyl]-4,4-dimethyl-5H-1,3-oxazole
InChI:
InChI=1S/C16H19FN2O2/c1-15(2)8-20-13(18-15)10-6-5-7-11(12(10)17)14-19-16(3,4)9-21-14/h5-7H,8-9H2,1-4H3
InChI Key:
YKKCUEKLYPOEDE-UHFFFAOYSA-N
SMILES:
CC1(C)COC(=N1)c1cccc(c1F)C1=NC(CO1)(C)C
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.143g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.338g/mol
Monoisotopic Mass:
290.143g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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