Nombre: N,N-diethyl-N-[3-(3-nitrophenoxy)propyl]amine
SMILES:
CCN(CC)CCCOc1cccc([N+](=O)[O-])c1Molecular Processing
Molecular formula
C13H20N2O3
Molecular weight
252.31
Exact mass
252.1474
XLogP
2.71
TPSA
55.61
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
71
Supplementary Information
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