CC1=C(C)C(c2ccccc2C=O)C(C)=C1C
Nom: 2-(2,3,4,5-tetramethylcyclopentadienyl)benzaldehyde
SMILES: CC1=C(C)C(c2ccccc2C=O)C(C)=C1C

Molecular Processing

Molecular formula
C16H18O
Molecular weight
226.32
Exact mass
226.1358
XLogP
4.27
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
71.32

Supplementary Information

Récupération des détails…

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