Name: (2-bromo-5-iodo-phenyl)-(2,3-dihydro-benzo[1,4]dioxin-6-yl)-methanone
SMILES:
O=C(c1ccc2c(c1)OCCO2)c1cc(I)ccc1BrMolecular Processing
Molecular formula
C15H10BrIO3
Molecular weight
445.05
Exact mass
443.8858
XLogP
4.06
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
87.72
Supplementary Information
Details werden geladen…
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