SMILES:
COc1ccc(C)cc1Molecular Processing
Molecular formula
C8H10O
Molecular weight
122.17
Exact mass
122.0732
XLogP
2
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
37.73
Supplementary Information
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