SMILES:
C/C(N)=C/C(=O)OCc1ccc(Cl)cc1Molecular Processing
Molecular formula
C11H12ClNO2
Molecular weight
225.68
Exact mass
225.0557
XLogP
2.25
TPSA
52.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
15
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
0.182
Molar refractivity
59.19
Supplementary Information
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