SMILES:
OCC#CCOc1ccccc1Molecular Processing
Molecular formula
C10H10O2
Molecular weight
162.19
Exact mass
162.0681
XLogP
1.06
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
46.8
Supplementary Information
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