SMILES:
O=C(c1ccc(Cl)cc1Cl)c1oc2cc(Br)ccc2c1CBrMolecular Processing
Molecular formula
C16H8Br2Cl2O2
Molecular weight
462.95
Exact mass
459.8268
XLogP
6.63
TPSA
30.21
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
96.44
Supplementary Information
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