الاسم: (E)-3-(2-propyl-phenoxy)-but-2-enoic acid ethyl ester
SMILES:
CCCc1ccccc1O/C(C)=C/C(=O)OCCMolecular Processing
Molecular formula
C15H20O3
Molecular weight
248.32
Exact mass
248.1412
XLogP
3.48
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
18
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
0.4
Molar refractivity
71.46
Supplementary Information
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