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89724-11-8 | 4-Oxazolemethanol, 5-methyl-2-[2-[3-(trifluoromethyl)phenyl]ethenyl]-
CAS No: 89724-11-8 Catalog No: AG00420B MDL No:
Product Description
Catalog Number:
AG00420B
Chemical Name:
4-Oxazolemethanol, 5-methyl-2-[2-[3-(trifluoromethyl)phenyl]ethenyl]-
CAS Number:
89724-11-8
Molecular Formula:
C14H12F3NO2
Molecular Weight:
283.2458
IUPAC Name:
[5-methyl-2-[2-[3-(trifluoromethyl)phenyl]ethenyl]-1,3-oxazol-4-yl]methanol
InChI:
InChI=1S/C14H12F3NO2/c1-9-12(8-19)18-13(20-9)6-5-10-3-2-4-11(7-10)14(15,16)17/h2-7,19H,8H2,1H3
InChI Key:
QGYQPQINMNTARU-UHFFFAOYSA-N
SMILES:
OCc1nc(oc1C)C=Cc1cccc(c1)C(F)(F)F
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.082g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.25g/mol
Monoisotopic Mass:
283.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.1
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