Name: 2-(1-hydroxy-2-methylpropan-2-yl)isoindoline-1,3-dione
SMILES:
CC(C)(CO)N1C(=O)c2ccccc2C1=OMolecular Processing
Molecular formula
C12H13NO3
Molecular weight
219.24
Exact mass
219.0895
XLogP
1.05
TPSA
57.61
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
58.11
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→