CCOC(=O)CNc1ccc(Cl)c(Cl)c1
Name: ethyl 3,4-dichloroanilinoacetate
SMILES: CCOC(=O)CNc1ccc(Cl)c(Cl)c1

Molecular Processing

Molecular formula
C10H11Cl2NO2
Molecular weight
248.11
Exact mass
247.0167
XLogP
2.97
TPSA
38.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
61.58

Supplementary Information

Details werden geladen…

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