SMILES:
OC1(Cc2ccccc2)CCNCC1Molecular Processing
Molecular formula
C12H17NO
Molecular weight
191.27
Exact mass
191.131
XLogP
1.34
TPSA
32.26
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
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
0.5
Molar refractivity
57.2
Supplementary Information
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Involved in 104 reactions→