SMILES:
CC(C)CCOCCCCCCOCCCCCCOCc1ccc2c(c1)OCO2Molecular Processing
Molecular formula
C25H42O5
Molecular weight
422.61
Exact mass
422.3032
XLogP
6.13
TPSA
46.15
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
19
Heavy atoms
30
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.76
Molar refractivity
120.25
Supplementary Information
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