이름: 6-(3-diethylaminopropoxy)-2,4-difluoronitrobenzene
SMILES:
CCN(CC)CCCOc1cc(F)cc(F)c1[N+](=O)[O-]Molecular Processing
Molecular formula
C13H18F2N2O3
Molecular weight
288.29
Exact mass
288.1285
XLogP
2.98
TPSA
55.61
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
70.91
Supplementary Information
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