SMILES:
CCCCCCOc1c(Br)ccc2c(OCCCCCC)c(Br)ccc12Molecular Processing
Molecular formula
C22H30Br2O2
Molecular weight
486.29
Exact mass
484.0613
XLogP
8.28
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
12
Heavy atoms
26
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.545
Molar refractivity
118.62
Supplementary Information
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