SMILES:
CC(C)(C)c1cc(CBr)cc(C(C)(C)C)c1OMolecular Processing
Molecular formula
C15H23BrO
Molecular weight
299.25
Exact mass
298.0932
XLogP
4.88
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
78.14
Supplementary Information
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