SMILES:
CC(O)CCOc1ccccc1Molecular Processing
Molecular formula
C10H14O2
Molecular weight
166.22
Exact mass
166.0994
XLogP
1.84
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
48.23
Supplementary Information
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