CCOC(=O)C(Br)c1ccc(Cl)c(Cl)c1
SMILES: CCOC(=O)C(Br)c1ccc(Cl)c(Cl)c1

Molecular Processing

Molecular formula
C10H9BrCl2O2
Molecular weight
311.99
Exact mass
309.9163
XLogP
3.99
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
64.76

Supplementary Information

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