COc1cc2c(cc1OC)CNC2
Name: 5,6-dimethoxyisoindoline
SMILES: COc1cc2c(cc1OC)CNC2

Molecular Processing

Molecular formula
C10H13NO2
Molecular weight
179.22
Exact mass
179.0946
XLogP
1.31
TPSA
30.49
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
50.09

Supplementary Information

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