SMILES:
COCC1OC2(CCCCC2)OC1C(Cl)=NOMolecular Processing
Molecular formula
C11H18ClNO4
Molecular weight
263.72
Exact mass
263.0924
XLogP
2.1
TPSA
60.28
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.909
Molar refractivity
62.51
Supplementary Information
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