CCOP(=O)(Cl)Cl.O=C([O-])C1(CCO)C=CC(CCO)(C(=O)[O-])C=C1
SMILES: CCOP(=O)(Cl)Cl.O=C([O-])C1(CCO)C=CC(CCO)(C(=O)[O-])C=C1

Molecular Processing

Molecular formula
C14H19Cl2O8P-2
Molecular weight
417.18
Exact mass
416.0206
XLogP
-0.04
TPSA
147.02
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
25
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
-2
Heteroatoms
11
Covalent units
2
Fraction Csp3
0.571
Molar refractivity
87.5

Supplementary Information

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