이름: E-3-(4-fluorophenyl)propenoic acid
SMILES:
O=C(O)/C=C/c1ccc(F)cc1Molecular Processing
Molecular formula
C9H7FO2
Molecular weight
166.15
Exact mass
166.043
XLogP
1.92
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
43.07
Supplementary Information
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