O=C(O)c1ccc(-c2cccc(Cl)c2)o1
SMILES: O=C(O)c1ccc(-c2cccc(Cl)c2)o1

Molecular Processing

Molecular formula
C11H7ClO3
Molecular weight
222.63
Exact mass
222.0084
XLogP
3.3
TPSA
50.44
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
56.11

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→