SMILES:
CC1CCCN1C1CC(c2ccc(Br)cc2)C1Molecular Processing
Molecular formula
C15H20BrN
Molecular weight
294.24
Exact mass
293.0779
XLogP
4.18
TPSA
3.24
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
17
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
75.31
Supplementary Information
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