CC(C)(C)C1=CC2=C(C(=C1)C(C)(C)C)OC(=O)C2C3=CC=C(C=C3)O
Name: 5,7-ditert-butyl-3-(4-hydroxyphenyl)-3H-1-benzofuran-2-one
SMILES: CC(C)(C)C1=CC2=C(C(=C1)C(C)(C)C)OC(=O)C2C3=CC=C(C=C3)O

Molecular Processing

Molecular formula
C22H26O3
Molecular weight
338.45
Exact mass
338.1882
XLogP
5.04
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
99.43

Supplementary Information

InChIKey: OOKTZSOAVMJNDN-UHFFFAOYSA-N
Synonyms
SCHEMBL493693SCHEMBL29478047OOKTZSOAVMJNDN-UHFFFAOYSA-N5,7-di-tert-butyl-3-(4-hydroxyphenyl)benzofuran-2-one
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Involved in 5 reactions→

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