Name: 1-[4-(2,2-dibromovinyl)cyclohexyl]-4-propyl-2,6,7-trioxabicyclo[2.2.2]octane
SMILES:
CCCC12COC(C3CCC(C=C(Br)Br)CC3)(OC1)OC2Molecular Processing
Molecular formula
C16H24Br2O3
Molecular weight
424.17
Exact mass
422.0092
XLogP
4.94
TPSA
27.69
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
21
Rings
4
Aromatic rings
0
Saturated rings
4
Aliphatic rings
4
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.875
Molar refractivity
89.31
Supplementary Information
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Involved in 6 reactions→