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Home > Fluorides > 141819-91-2
141819-91-2 | 4-Oxazoleethanol, 5-methyl-2-[4-(trifluoromethyl)phenyl]-
CAS No: 141819-91-2 Catalog No: AG001H8L MDL No:MFCD14706799
Product Description
Catalog Number:
AG001H8L
Chemical Name:
4-Oxazoleethanol, 5-methyl-2-[4-(trifluoromethyl)phenyl]-
CAS Number:
141819-91-2
Molecular Formula:
C13H12F3NO2
Molecular Weight:
271.2351
MDL Number:
MFCD14706799
IUPAC Name:
2-[5-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl]ethanol
InChI:
InChI=1S/C13H12F3NO2/c1-8-11(6-7-18)17-12(19-8)9-2-4-10(5-3-9)13(14,15)16/h2-5,18H,6-7H2,1H3
InChI Key:
BQYBIZJTLUWSLE-UHFFFAOYSA-N
SMILES:
OCCc1nc(oc1C)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.082g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.239g/mol
Monoisotopic Mass:
271.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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