الاسم: (E)-3-(3-trifluoromethoxy-phenoxy)-but-2-enoic acid ethyl ester
SMILES:
CCOC(=O)/C=C(\C)Oc1cccc(OC(F)(F)F)c1Molecular Processing
Molecular formula
C13H13F3O4
Molecular weight
290.24
Exact mass
290.0766
XLogP
3.43
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
64.14
Supplementary Information
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