O=C(Cl)CCCc1cccc2ccccc12
SMILES: O=C(Cl)CCCc1cccc2ccccc12

Molecular Processing

Molecular formula
C14H13ClO
Molecular weight
232.71
Exact mass
232.0655
XLogP
3.93
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
67.75

Supplementary Information

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