SMILES:
COC(=O)c1cc(Br)c(F)cc1OCMolecular Processing
Molecular formula
C9H8BrFO3
Molecular weight
263.06
Exact mass
261.9641
XLogP
2.38
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
51.99
Supplementary Information
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