SMILES:
COC(=O)c1cc(C2OCCO2)c(Cl)nc1C(=O)OCMolecular Processing
Molecular formula
C12H12ClNO6
Molecular weight
301.68
Exact mass
301.0353
XLogP
1.35
TPSA
83.95
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
66.57
Supplementary Information
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