SMILES:
COc1ccc2cc(C3(C)COC(=O)N3)ccc2c1Molecular Processing
Molecular formula
C15H15NO3
Molecular weight
257.29
Exact mass
257.1052
XLogP
2.8
TPSA
47.56
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
72.34
Supplementary Information
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