COc1ccc2c(c1)C(C)=NCC2
Nom: 7-methoxy-1-methyl-3,4-dihydro-isoquinoline
SMILES: COc1ccc2c(c1)C(C)=NCC2

Molecular Processing

Molecular formula
C11H13NO
Molecular weight
175.23
Exact mass
175.0997
XLogP
2.06
TPSA
21.59
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
53.78

Supplementary Information

Récupération des détails…

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