SMILES:
O=C(O)Cc1ccccc1CN1CCOCC1Molecular Processing
Molecular formula
C13H17NO3
Molecular weight
235.28
Exact mass
235.1208
XLogP
1.15
TPSA
49.77
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
63.88
Supplementary Information
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