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89150-18-5 | Oxazole, 2,5-dimethyl-4-[4-(trifluoromethyl)phenyl]-
CAS No: 89150-18-5 Catalog No: AG003WSV MDL No:
Product Description
Catalog Number:
AG003WSV
Chemical Name:
Oxazole, 2,5-dimethyl-4-[4-(trifluoromethyl)phenyl]-
CAS Number:
89150-18-5
Molecular Formula:
C12H10F3NO
Molecular Weight:
241.2091
IUPAC Name:
2,5-dimethyl-4-[4-(trifluoromethyl)phenyl]-1,3-oxazole
InChI:
InChI=1S/C12H10F3NO/c1-7-11(16-8(2)17-7)9-3-5-10(6-4-9)12(13,14)15/h3-6H,1-2H3
InChI Key:
YTEVYKQFTPDAHY-UHFFFAOYSA-N
SMILES:
Cc1oc(c(n1)c1ccc(cc1)C(F)(F)F)C
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.071g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.213g/mol
Monoisotopic Mass:
241.071g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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