Name: 4,5-dichloro-2-(2,3-dimethoxyphenoxy)aniline
SMILES:
COc1cccc(Oc2cc(Cl)c(Cl)cc2N)c1OCMolecular Processing
Molecular formula
C14H13Cl2NO3
Molecular weight
314.17
Exact mass
313.0272
XLogP
4.39
TPSA
53.71
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
80.49
Supplementary Information
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