SMILES:
O=C(C=C1CCCCN1)c1ccccc1Molecular Processing
Molecular formula
C13H15NO
Molecular weight
201.27
Exact mass
201.1154
XLogP
2.53
TPSA
29.1
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
60.71
Supplementary Information
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