CC(C)(C)c1ccc(OCC(=O)O)cc1OCC1CC1
SMILES: CC(C)(C)c1ccc(OCC(=O)O)cc1OCC1CC1

Molecular Processing

Molecular formula
C16H22O4
Molecular weight
278.35
Exact mass
278.1518
XLogP
3.24
TPSA
55.76
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
76.49

Supplementary Information

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