CCCCOC(=O)C1OC(OCC)C=CC1C
SMILES: CCCCOC(=O)C1OC(OCC)C=CC1C

Molecular Processing

Molecular formula
C13H22O4
Molecular weight
242.31
Exact mass
242.1518
XLogP
2.28
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
17
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.769
Molar refractivity
64.46

Supplementary Information

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