SMILES:
OCC1OC(O)(c2ccc(Cl)c(Cc3ccc(O)cc3)c2)C(O)C(O)C1OMolecular Processing
Molecular formula
C19H21ClO7
Molecular weight
396.82
Exact mass
396.0976
XLogP
0.26
TPSA
130.61
H-bond donors
6
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
96.24
Supplementary Information
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