الاسم: 5-(3-trifluoromethylphenyl)furoic acid
SMILES:
O=C(O)c1ccc(-c2cccc(C(F)(F)F)c2)o1Molecular Processing
Molecular formula
C12H7F3O3
Molecular weight
256.18
Exact mass
256.0347
XLogP
3.66
TPSA
50.44
H-bond donors
1
H-bond acceptors
2
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
6
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
56.11
Supplementary Information
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