이름: 6-(trifluoromethyl)-isatoic acid anhydride
SMILES:
O=c1[nH]c2cccc(C(F)(F)F)c2c(=O)o1Molecular Processing
Molecular formula
C9H4F3NO3
Molecular weight
231.13
Exact mass
231.0143
XLogP
1.5
TPSA
63.07
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
48.11
Supplementary Information
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