Name: 3-(chloromethyl) indole
SMILES:
ClCc1c[nH]c2ccccc12Molecular Processing
Molecular formula
C9H8ClN
Molecular weight
165.62
Exact mass
165.0345
XLogP
2.91
TPSA
15.79
H-bond donors
1
H-bond acceptors
0
Rotatable bonds
1
Heavy atoms
11
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
47.86
Supplementary Information
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