名称: 4-(4-cyanocyclohexyl)-4'-pentylbiphenyl
SMILES:
CCCCCc1ccc(-c2ccc(C3CCC(C#N)CC3)cc2)cc1Molecular Processing
Molecular formula
C24H29N
Molecular weight
331.5
Exact mass
331.23
XLogP
6.88
TPSA
23.79
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
105.42
Supplementary Information
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