C=CCOc1cc(N)c(Cl)cc1Cl
Name: 3-(allyloxy)-4,6-dichloroaniline
SMILES: C=CCOc1cc(N)c(Cl)cc1Cl

Molecular Processing

Molecular formula
C9H9Cl2NO
Molecular weight
218.08
Exact mass
217.0061
XLogP
3.14
TPSA
35.25
H-bond donors
1
H-bond acceptors
2
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
4
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
56.57

Supplementary Information

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