SMILES:
O=C1Cc2ccc(Br)cc2Oc2cc(O)cc(O)c21Molecular Processing
Molecular formula
C14H9BrO4
Molecular weight
321.13
Exact mass
319.9684
XLogP
3.39
TPSA
66.76
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
19
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
0.071
Molar refractivity
72.02
Supplementary Information
Details werden geladen…
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