Name: α-bromoisopropyl 2,2,3,3-tetrafluoro-1,4-benzodioxan-6-yl ketone
SMILES:
CC(C)(Br)C(=O)c1ccc2c(c1)OC(F)(F)C(F)(F)O2Molecular Processing
Molecular formula
C12H9BrF4O3
Molecular weight
357.1
Exact mass
355.9671
XLogP
4
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
64.93
Supplementary Information
Details werden geladen…
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