이름: butyl 2-(4-methylphenyl)-2,2-dimethylacetate
SMILES:
CCCCOC(=O)C(C)(C)c1ccc(C)cc1Molecular Processing
Molecular formula
C15H22O2
Molecular weight
234.34
Exact mass
234.162
XLogP
3.62
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
70.07
Supplementary Information
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