Name: 2-(3,5-di(t-butyl)-benzylidene)cyclopentanone
SMILES:
CC(C)(C)c1cc(C=C2CCCC2=O)cc(C(C)(C)C)c1Molecular Processing
Molecular formula
C20H28O
Molecular weight
284.44
Exact mass
284.214
XLogP
5.42
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.55
Molar refractivity
90.68
Supplementary Information
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