Name: α,3-dichloro-4-hydroxy-5-(t-butyl)benzaldoxime
SMILES:
CC(C)(C)c1cc(C(Cl)=NO)cc(Cl)c1OMolecular Processing
Molecular formula
C11H13Cl2NO2
Molecular weight
262.14
Exact mass
261.0323
XLogP
3.72
TPSA
52.82
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
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
0.364
Molar refractivity
65.99
Supplementary Information
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