Name: (S)-3-(2-Amino-3-nitrophenoxy)-1,2-epoxypropane
SMILES:
Nc1c(OC[C@@H]2CO2)cccc1[N+](=O)[O-]Molecular Processing
Molecular formula
C9H10N2O4
Molecular weight
210.19
Exact mass
210.0641
XLogP
0.95
TPSA
90.92
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
52.74
Supplementary Information
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