SMILES:
CCc1ccc(Cc2cccc3cc(COC(C)(C)OC)c(Br)cc23)cc1Molecular Processing
Molecular formula
C24H27BrO2
Molecular weight
427.38
Exact mass
426.1194
XLogP
6.65
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
7
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
116.15
Supplementary Information
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