الاسم: (E)-4-bromo-3-(2,3-dimethoxy-phenoxy)-but-2-enoic acid ethyl ester
SMILES:
CCOC(=O)/C=C(\CBr)Oc1cccc(OC)c1OCMolecular Processing
Molecular formula
C14H17BrO5
Molecular weight
345.19
Exact mass
344.0259
XLogP
2.92
TPSA
53.99
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
78.68
Supplementary Information
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