CCOC(=O)C(=O)c1ccc(C2CCCCC2)c(C(F)(F)F)c1
SMILES: CCOC(=O)C(=O)c1ccc(C2CCCCC2)c(C(F)(F)F)c1

Molecular Processing

Molecular formula
C17H19F3O3
Molecular weight
328.33
Exact mass
328.1286
XLogP
4.5
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
78.23

Supplementary Information

詳細情報を取得中…

19 件の反応に参加