CCOP(=O)(OCC)Oc1ccc(/C(C)=C/C(=O)Oc2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl)cc1
Name: 11b1
SMILES: CCOP(=O)(OCC)Oc1ccc(/C(C)=C/C(=O)Oc2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl)cc1

Molecular Processing

Molecular formula
C20H18Cl5O6P
Molecular weight
562.6
Exact mass
559.9284
XLogP
8.52
TPSA
71.06
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
32
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
128.71

Supplementary Information

No supplementary data available

Involved in 2 reactions