SMILES:
O=C1c2cc(Br)cc(Br)c2CCC1BrMolecular Processing
Molecular formula
C10H7Br3O
Molecular weight
382.88
Exact mass
379.8047
XLogP
4.1
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
67.21
Supplementary Information
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