O=C(c1ccc(O)cc1)c1c(-c2ccccc2)oc2ccc(Cl)cc12
Name: 5-chloro-3-(4-hydroxybenzoyl)-2-phenylbenzofuran
SMILES: O=C(c1ccc(O)cc1)c1c(-c2ccccc2)oc2ccc(Cl)cc12

Molecular Processing

Molecular formula
C21H13ClO3
Molecular weight
348.79
Exact mass
348.0553
XLogP
5.69
TPSA
50.44
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
25
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
98.2

Supplementary Information

Details werden geladen…

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