Name: methyl 2-(methylamino)-3-nitrobenzoate
SMILES:
CNc1c(C(=O)OC)cccc1[N+](=O)[O-]Molecular Processing
Molecular formula
C9H10N2O4
Molecular weight
210.19
Exact mass
210.0641
XLogP
1.42
TPSA
81.47
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
53.98
Supplementary Information
Details werden geladen…
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