C=Cc1ccc2c(c1)C(=O)NCC2
SMILES: C=Cc1ccc2c(c1)C(=O)NCC2

Molecular Processing

Molecular formula
C11H11NO
Molecular weight
173.21
Exact mass
173.0841
XLogP
1.62
TPSA
29.1
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
52.57

Supplementary Information

詳細情報を取得中…

6 件の反応に参加