CCOC(=O)C1CCc2ccc(OCc3ccccc3)cc2O1
Name: ether ester
SMILES: CCOC(=O)C1CCc2ccc(OCc3ccccc3)cc2O1

Molecular Processing

Molecular formula
C19H20O4
Molecular weight
312.37
Exact mass
312.1362
XLogP
3.52
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
86.59

Supplementary Information

Details werden geladen…

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