SMILES:
Oc1ccc(C2=CCCCCC2)cc1Molecular Processing
Molecular formula
C13H16O
Molecular weight
188.27
Exact mass
188.1201
XLogP
3.74
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
59.17
Supplementary Information
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