الاسم: 3-ethoxy-4-methoxybenzonitrile
SMILES:
CCOc1cc(C#N)ccc1OCMolecular Processing
Molecular formula
C10H11NO2
Molecular weight
177.2
Exact mass
177.079
XLogP
1.97
TPSA
42.25
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
13
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
0.3
Molar refractivity
48.88
Supplementary Information
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