Cc1ccc(S(=O)(=O)OCC2CCC2)cc1
SMILES: Cc1ccc(S(=O)(=O)OCC2CCC2)cc1

Molecular Processing

Molecular formula
C12H16O3S
Molecular weight
240.32
Exact mass
240.082
XLogP
2.5
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
61.66

Supplementary Information

詳細情報を取得中…

21 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→