CC(=O)c1cccc2c1OC1(CC1)C2=O
SMILES: CC(=O)c1cccc2c1OC1(CC1)C2=O

Molecular Processing

Molecular formula
C12H10O3
Molecular weight
202.21
Exact mass
202.063
XLogP
2
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
15
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
53.37

Supplementary Information

詳細情報を取得中…

3 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→