COc1ccc(C2C(C)(C)C2(Cl)Cl)cc1
Name: p-(2,2-Dichloro-3,3-dimethylcyclopropyl)anisole
SMILES: COc1ccc(C2C(C)(C)C2(Cl)Cl)cc1

Molecular Processing

Molecular formula
C12H14Cl2O
Molecular weight
245.15
Exact mass
244.0422
XLogP
3.99
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
63.95

Supplementary Information

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