SMILES:
CCOCn1c(Br)c(Br)c(S(=O)(=O)C(F)(F)F)c1-c1ccc(Cl)cc1Molecular Processing
Molecular formula
C14H11Br2ClF3NO3S
Molecular weight
525.57
Exact mass
522.8467
XLogP
5.62
TPSA
48.3
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
95.14
Supplementary Information
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