이름: 2-(4-Isopropoxy-3-methoxy-phenyl)-2-methyl-propionic acid ethyl ester
SMILES:
CCOC(=O)C(C)(C)c1ccc(OC(C)C)c(OC)c1Molecular Processing
Molecular formula
C16H24O4
Molecular weight
280.36
Exact mass
280.1675
XLogP
3.32
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
78.42
Supplementary Information
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