الاسم: ethyl 2-(octahydro-1H-isoindol-1-yl)acetate
SMILES:
CCOC(=O)CC1NCC2CCCCC21Molecular Processing
Molecular formula
C12H21NO2
Molecular weight
211.3
Exact mass
211.1572
XLogP
1.72
TPSA
38.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
15
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.917
Molar refractivity
58.49
Supplementary Information
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