SMILES:
CC1CCCN1CCCOc1ccc(Br)cc1FMolecular Processing
Molecular formula
C14H19BrFNO
Molecular weight
316.21
Exact mass
315.0634
XLogP
3.84
TPSA
12.47
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
74.48
Supplementary Information
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