O=C(C=CI)c1ccc(Cl)cc1
SMILES: O=C(C=CI)c1ccc(Cl)cc1

Molecular Processing

Molecular formula
C9H6ClIO
Molecular weight
292.5
Exact mass
291.9152
XLogP
3.47
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
58.94

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→