이름: product
SMILES:
O=[N+]([O-])c1cc2c(cc1[N+](=O)[O-])OC(CC(F)(F)F)(C(F)(F)F)O2Molecular Processing
Molecular formula
C10H4F6N2O6
Molecular weight
362.14
Exact mass
361.9974
XLogP
3.49
TPSA
104.74
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
60.46
Supplementary Information
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