이름: 5-amino-2,2-difluorobenzodioxole
SMILES:
Nc1ccc2c(c1)OC(F)(F)O2Molecular Processing
Molecular formula
C7H5F2NO2
Molecular weight
173.12
Exact mass
173.0288
XLogP
1.59
TPSA
44.48
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
37.06
Supplementary Information
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