SMILES:
CC(C)C(CC=C(Cl)Cl)C(=O)OMolecular Processing
Molecular formula
C8H12Cl2O2
Molecular weight
211.09
Exact mass
210.0214
XLogP
3.05
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
12
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
0.625
Molar refractivity
50.37
Supplementary Information
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