CC(C)(C)c1ccc(-c2scc(C=O)c2O)cc1
名称: 2-(4-t-Butylphenyl)-3-hydroxy-4-formylthiophene
SMILES: CC(C)(C)c1ccc(-c2scc(C=O)c2O)cc1

Molecular Processing

Molecular formula
C15H16O2S
Molecular weight
260.36
Exact mass
260.0871
XLogP
4.23
TPSA
37.3
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
75.51

Supplementary Information

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