CC(C)(C)OC(=O)N1CC(OC(F)F)CC1C(=O)OCC(=O)c1ccc(Br)cc1
SMILES: CC(C)(C)OC(=O)N1CC(OC(F)F)CC1C(=O)OCC(=O)c1ccc(Br)cc1

Molecular Processing

Molecular formula
C19H22BrF2NO6
Molecular weight
478.29
Exact mass
477.0599
XLogP
3.79
TPSA
82.14
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
29
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.526
Molar refractivity
101.65

Supplementary Information

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