Name: 3-(4-[2-(tetrahydropyran-2-yloxy)ethyl]phenoxy)propyl acetoacetate
SMILES:
CC(=O)CC(=O)OCCCOc1ccc(CCOC2CCCCO2)cc1Molecular Processing
Molecular formula
C20H28O6
Molecular weight
364.44
Exact mass
364.1886
XLogP
3.06
TPSA
71.06
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
26
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
96.06
Supplementary Information
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