SMILES:
Cc1ccc(C)c(NCC=O)c1CMolecular Processing
Molecular formula
C11H15NO
Molecular weight
177.25
Exact mass
177.1154
XLogP
2.22
TPSA
29.1
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
13
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
0.364
Molar refractivity
55.21
Supplementary Information
Obteniendo detalles…
Participa en 6 reacciones→