O=C1C2=C(C(=O)c3ccccc31)C(O)=CCC2
이름: 1-hydroxy-3,4-dihydroanthraquinone
SMILES: O=C1C2=C(C(=O)c3ccccc31)C(O)=CCC2

Molecular Processing

Molecular formula
C14H10O3
Molecular weight
226.23
Exact mass
226.063
XLogP
2.6
TPSA
54.37
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
17
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
62.07

Supplementary Information

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