SMILES:
Clc1ncc(C2CC2)cn1Molecular Processing
Molecular formula
C7H7ClN2
Molecular weight
154.6
Exact mass
154.0298
XLogP
2.01
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
39.02
Supplementary Information
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