CN1C(=O)CC(C)(C)c2cc(Br)ccc21
SMILES: CN1C(=O)CC(C)(C)c2cc(Br)ccc21

Molecular Processing

Molecular formula
C12H14BrNO
Molecular weight
268.15
Exact mass
267.0259
XLogP
3.09
TPSA
20.31
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
65.2

Supplementary Information

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