Oc1cc(O)c(C23CC4CC(CC(C4)C2)C3)cc1C12CC3CC(CC(C3)C1)C2
Name: 4,6-bis(1-adamantyl)-1,3-dihydroxybenzene
SMILES: Oc1cc(O)c(C23CC4CC(CC(C4)C2)C3)cc1C12CC3CC(CC(C3)C1)C2

Molecular Processing

Molecular formula
C26H34O2
Molecular weight
378.56
Exact mass
378.2559
XLogP
6.03
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
28
Rings
9
Aromatic rings
1
Saturated rings
8
Aliphatic rings
8
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.769
Molar refractivity
109.47

Supplementary Information

Details werden geladen…

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