CC(C)C(C(N)=O)c1ccc(C(F)(F)F)cc1Cl
名称: 2-(2-chloro-4-trifluoromethylphenyl)-3-methylbutyramide
SMILES: CC(C)C(C(N)=O)c1ccc(C(F)(F)F)cc1Cl

Molecular Processing

Molecular formula
C12H13ClF3NO
Molecular weight
279.69
Exact mass
279.0638
XLogP
3.58
TPSA
43.09
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
63.23

Supplementary Information

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