Name: 4-chlorothiosalicylic acid
SMILES:
O=C(O)c1ccc(Cl)cc1SMolecular Processing
Molecular formula
C7H5ClO2S
Molecular weight
188.63
Exact mass
187.9699
XLogP
2.33
TPSA
37.3
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
45.66
Supplementary Information
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