이름: 1-(3-phenylpropyl)cyclododecane
SMILES:
c1ccc(CCCC2CCCCCCCCCCC2)cc1Molecular Processing
Molecular formula
C21H34
Molecular weight
286.5
Exact mass
286.2661
XLogP
6.93
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
0
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
93.66
Supplementary Information
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