CC(C)(C)OC(=O)C1C(C#CC(=O)OCC(Cl)(Cl)Cl)C1(C)C
SMILES: CC(C)(C)OC(=O)C1C(C#CC(=O)OCC(Cl)(Cl)Cl)C1(C)C

Molecular Processing

Molecular formula
C15H19Cl3O4
Molecular weight
369.67
Exact mass
368.0349
XLogP
3.52
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.733
Molar refractivity
85.63

Supplementary Information

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