Name: compound
SMILES:
O=Cc1c[nH]c(C(=O)C(Cl)(Cl)Cl)c1Molecular Processing
Molecular formula
C7H4Cl3NO2
Molecular weight
240.47
Exact mass
238.9308
XLogP
2.38
TPSA
49.93
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
50.8
Supplementary Information
Details werden geladen…
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