Name: 2-(2-chloro-ethyl)-2,3-dihydro-1H-isoindole
SMILES:
ClCCN1Cc2ccccc2C1Molecular Processing
Molecular formula
C10H12ClN
Molecular weight
181.67
Exact mass
181.0658
XLogP
2.24
TPSA
3.24
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
12
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
0.4
Molar refractivity
51.28
Supplementary Information
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