CCC(C)c1ccc2ccc3cccnc3c2n1
Name: 2-(2-butyl)-1,10-phenanthroline
SMILES: CCC(C)c1ccc2ccc3cccnc3c2n1

Molecular Processing

Molecular formula
C16H16N2
Molecular weight
236.32
Exact mass
236.1313
XLogP
4.3
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
18
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
75.75

Supplementary Information

Details werden geladen…

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