O=C(O)c1ncoc1-c1cccc(C(F)(F)F)c1
이름: 5-(3-trifluoromethyl-phenyl)-oxazole-4-carboxylic acid
SMILES: O=C(O)c1ncoc1-c1cccc(C(F)(F)F)c1

Molecular Processing

Molecular formula
C11H6F3NO3
Molecular weight
257.17
Exact mass
257.03
XLogP
3.06
TPSA
63.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
53.9

Supplementary Information

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