SMILES:
C=C(C)CC(O)C(Cl)(Cl)ClMolecular Processing
Molecular formula
C6H9Cl3O
Molecular weight
203.5
Exact mass
201.9719
XLogP
2.68
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
10
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
45.73
Supplementary Information
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