COC(=O)C(C)(C)CCCOc1cc(C)c(OC)cc1C
الاسم: 5-(4-methoxy-2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid, methyl ester
SMILES: COC(=O)C(C)(C)CCCOc1cc(C)c(OC)cc1C

Molecular Processing

Molecular formula
C17H26O4
Molecular weight
294.39
Exact mass
294.1831
XLogP
3.67
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
21
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
0.588
Molar refractivity
82.99

Supplementary Information

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