Name: ethyl 2-[4-(1-hydroxyethyl)phenoxy]-2-methylpropionate
SMILES:
CCOC(=O)C(C)(C)Oc1ccc(C(C)O)cc1Molecular Processing
Molecular formula
C14H20O4
Molecular weight
252.31
Exact mass
252.1362
XLogP
2.46
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
68.42
Supplementary Information
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