| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2005 | 13 | No |
Popular Name: 5-Nitrooxindole 5-Nitrooxindole
Find On: PubMed — Wikipedia — Google
CAS Numbers: 20870-79-5 , [20870-79-5]
2H-Indol-2-one, 1,3-dihydro-5-nitro-
5-nitro-1,3-dihydro-2H-indol-2-one
| 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) | 1.04 | 3.65 | -9.4 | 1 | 5 | 0 | 75 | 178.147 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 2.34 | -37.57 | 1 | 5 | -1 | 85 | 177.139 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 236 - 238 | Enamine Building Blocks |
| MP | 236...238 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0156603A2; EP0175551A1; EP0929520A1; US3972894; US3996264; US4056569; US4556672; US4652658; US4665194; US4690943; US4752609; US4808601; US6051593; US6114371; US6130238; US6147073; US6147106; USRE29882; WO1997045409A1; WO1998007695A1; WO1998050356A1; WO1 | IBM Patent Data |
