SMILES:
Brc1ccc2c(c1)CC(Cc1ccccc1)O2Molecular Processing
Molecular formula
C15H13BrO
Molecular weight
289.17
Exact mass
288.015
XLogP
4
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
17
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
72.41
Supplementary Information
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