SMILES:
C(=Cc1ccccc1)OCC1CO1Molecular Processing
Molecular formula
C11H12O2
Molecular weight
176.21
Exact mass
176.0837
XLogP
2.07
TPSA
21.76
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
51.17
Supplementary Information
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