SMILES:
CC(C)Cc1cc(CCC#N)ccc1OS(=O)(=O)C(F)(F)FMolecular Processing
Molecular formula
C14H16F3NO3S
Molecular weight
335.35
Exact mass
335.0803
XLogP
3.57
TPSA
67.16
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
74.52
Supplementary Information
جارٍ جلب التفاصيل…
مشارك في 7 تفاعل→