الاسم: (E)-4-bromo-3-(2-propyl-phenoxy)-but-2-enoic acid ethyl ester
SMILES:
CCCc1ccccc1O/C(=C/C(=O)OCC)CBrMolecular Processing
Molecular formula
C15H19BrO3
Molecular weight
327.22
Exact mass
326.0518
XLogP
3.86
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
79.58
Supplementary Information
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