Name: N1,N1-Dimethyl-N2-(4-nitro-phenyl)-propane-1,2-diamine
SMILES:
CC(CN(C)C)Nc1ccc([N+](=O)[O-])cc1Molecular Processing
Molecular formula
C11H17N3O2
Molecular weight
223.28
Exact mass
223.1321
XLogP
1.96
TPSA
58.41
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
64.74
Supplementary Information
Details werden geladen…
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