SMILES:
CC(C)(C)OC(=O)NCCCCOCc1cc(Br)ccc1FMolecular Processing
Molecular formula
C16H23BrFNO3
Molecular weight
376.27
Exact mass
375.0845
XLogP
4.41
TPSA
47.56
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
87.23
Supplementary Information
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