SMILES:
N#CC(Cl)Cc1ccc(Cl)cc1C(=O)c1ccccc1Molecular Processing
Molecular formula
C16H11Cl2NO
Molecular weight
304.18
Exact mass
303.0218
XLogP
4.24
TPSA
40.86
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
80.28
Supplementary Information
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