SMILES:
Clc1ccc2c(c1)CCC1=C2CCCN1Molecular Processing
Molecular formula
C13H14ClN
Molecular weight
219.71
Exact mass
219.0815
XLogP
3.38
TPSA
12.03
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
15
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
63.93
Supplementary Information
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Involved in 47 reactions→