O=C1CC2(CCCC2)c2ccccc21
SMILES: O=C1CC2(CCCC2)c2ccccc21

Molecular Processing

Molecular formula
C13H14O
Molecular weight
186.25
Exact mass
186.1045
XLogP
3.08
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
14
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
55.54

Supplementary Information

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