COC(=O)C(C)=Cc1ccc(N(C)C)cc1
SMILES: COC(=O)C(C)=Cc1ccc(N(C)C)cc1

Molecular Processing

Molecular formula
C13H17NO2
Molecular weight
219.28
Exact mass
219.1259
XLogP
2.33
TPSA
29.54
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
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
0.308
Molar refractivity
66.44

Supplementary Information

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