Название: 4-(2,6-di-tertiary-butylcyclohexadienon-4-ylideneamino)cinnamic acid
SMILES:
CC(C)(C)C1=CC(=Nc2ccc(C=CC(=O)O)cc2)C=C(C(C)(C)C)C1=OMolecular Processing
Molecular formula
C23H27NO3
Molecular weight
365.47
Exact mass
365.1991
XLogP
5.38
TPSA
66.73
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
27
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
110.29
Supplementary Information
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