In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 16 | No |
Popular Name: N-(2-Hydroxyethyl)-3-(4-nitrophenyl) propylamine N-(2-Hydroxyethyl)-3-(4-nitrophe…
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CAS Number: 130634-09-2
"N-(2-Hydroxyethyl)-3-(4-nitrophenyl) propylamine, 98%"
2-((3-(4-Nitrophenyl)propyl)amino)ethanol
N-(2-Hydroxyethyl)-3-(4-nitrophenyl)propylamine
N-(2-Hydroxyethyl-3-4-nitrophenyl) propylamine
N-(2-Hydroxyethyl£©-3-£¨4-nitrophenyl) propylamine C11H16N2O3
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.40 | 4.18 | -50.02 | 3 | 5 | 1 | 83 | 225.268 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 2.69 | -10.59 | 2 | 5 | 0 | 78 | 224.26 | 7 | ↓ |