SMILES:
N#CCCCCCOCCCc1ccc(OCCCCCC#N)cc1Molecular Processing
Molecular formula
C21H30N2O2
Molecular weight
342.48
Exact mass
342.2307
XLogP
5.18
TPSA
66.04
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
15
Heavy atoms
25
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
0.619
Molar refractivity
99.24
Supplementary Information
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