CCCCCCC(C)(C)c1ccc(C=O)c(OCc2ccccc2)c1
Name: 2-benzyloxy-4-(1,1-dimethylheptyl)benzaldehyde
SMILES: CCCCCCC(C)(C)c1ccc(C=O)c(OCc2ccccc2)c1

Molecular Processing

Molecular formula
C23H30O2
Molecular weight
338.49
Exact mass
338.2246
XLogP
6.33
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
10
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
104.39

Supplementary Information

Details werden geladen…

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