이름: alcohol
SMILES:
CCCCCCCCCCC[C@H](CCO)OCc1ccccc1Molecular Processing
Molecular formula
C21H36O2
Molecular weight
320.52
Exact mass
320.2715
XLogP
5.88
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
15
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
98.57
Supplementary Information
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