C9H11FN2O5 Uridine, 2′ -deoxy-2′ -fluoro- (7CI, 8CI, 9CI, ACI)
CAS rejisitra laharana
784-71-4
H228
| Toetra ara-batana fototra | sarobidy | toe-javatra |
| Lanja molekiola | 246.19 | - |
| Teboka fandrehitra (andrana) | 149-150 °C | - |
| Density (voavinavina) | 1,63±0,1 g/cm3 | Mafana: 20 °C;Press: 760 Torr |
| pKa (voavinavina) | 9.39±0.10 | Mafana asidra indrindra: 25 °C |
Canonical SMILES
O=C1C=CN(C(=O)N1)C2OC(CO)C(O)C2F
SMILES Isomerique
F[C@H]1[C@@H](O[C@H](CO)[C@H]1O)N2C(=O)NC(=O)C=C2
InChI
InChI= 1S/C9H11FN2O5/c10-6-7(15)4(3-13)17-8(6)12-2-1-5(14)11-9(12)16/h1-2,4, 6-8,13,15H,3H2,(H,11,14,16)/t4-,6-,7-,8-/m1/s1
InChI Key
UIYWFOZZIZEEKJ-XVFCMESISA-N
4 Anarana hafa ho an'ity akora ity
2′ -Deoxy-2′ -fluorouridine (ACI);1-(2-Deoxy-2-fluoro- β -D-ribofuranosyl)uracil;2′ -Fluoro-2′ -deoxyuridine;2′ -Fluoro-uridine
Properties misy
Optical sy Scattering
mafana
| NY FANANANA | sarobidy | toe-javatra | Source |
| Herin'ny Rotatory Optical | +52 deg | Solvent: Rano;λ: 589,3 nm;Mafana: 20 °C | (1) CAS |
(1) Codington, John F.;Journal of the American Chemical Society, (1961), 83, 5030-1, CAplus
| NY FANANANA | sarobidy | Loharanon'ny toe-javatra |
| Teboka mitsonika | 149-150 °C | (1) IC |
| Teboka mitsonika | Jereo ny lahatsoratra feno | (2) CAS |
| Teboka mitsonika | Jereo ny lahatsoratra feno | (3) IC |
(1) Mercer, John R.;Journal of Medicinal Chemistry, (1989), 32(6), 1289-94, CAplus
(2) Codington, John F.;Journal of the American Chemical Society, (1961), 83, 5030-1, CAplus
(3) Van Aerschot, A.;Bulletin des Societes Chimiques Belges, (1989), 98(12), 937-41, CAplus
Spectra misy
1 H NMR
13 C NMR
Hetero NMR
IR
-bahoaka
Ramana
UV sy Visible
Properties misy
niteraka
simika
hakitroky
Lipinski
Structure Related
| NY FANANANA | sarobidy | toe-javatra | Source |
| Bioconcentration Factor | 1.0 | pH 1;Mafana: 25 °C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 2;Mafana: 25 °C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 3;Mafana: 25 °C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 4;Mafana: 25 °C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 5;Mafana: 25 °C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 6;Mafana: 25 °C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 7;Mafana: 25 °C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 8;Mafana: 25 °C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 9;Mafana: 25 °C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 10;Mafana: 25 °C | (1) ACD |
(1) Kajy amin'ny alalan'ny Fampivoarana Chemistry Advanced (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| NY FANANANA | sarobidy | toe-javatra | Source |
| Koc | 12.1 | pH 1;Mafana: 25 °C | (1) ACD |
| Koc | 12.1 | pH 2;Mafana: 25 °C | (1) ACD |
| Koc | 12.1 | pH 3;Mafana: 25 °C | (1) ACD |
| Koc | 12.1 | pH 4;Mafana: 25 °C | (1) ACD |
| Koc | 12.1 | pH 5;Mafana: 25 °C | (1) ACD |
| Koc | 12.1 | pH 6;Mafana: 25 °C | (1) ACD |
| Koc | 12.1 | pH 7;Mafana: 25 °C | (1) ACD |
| Koc | 11.6 | pH 8;Mafana: 25 °C | (1) ACD |
| Koc | 8.45 | pH 9;Mafana: 25 °C | (1) ACD |
| Koc | 2.33 | pH 10;Mafana: 25 °C | (1) ACD |
| logD | -0.54 | pH 1;Mafana: 25 °C | (1) ACD |
| logD | -0.54 | pH 2;Mafana: 25 °C | (1) ACD |
| logD | -0.54 | pH 3;Mafana: 25 °C | (1) ACD |
| logD | -0.54 | pH 4;Mafana: 25 °C | (1) ACD |
| logD | -0.54 | pH 5;Mafana: 25 °C | (1) ACD |
| logD | -0.54 | pH 6;Mafana: 25 °C | (1) ACD |
| logD | -0.54 | pH 7;Mafana: 25 °C | (1) ACD |
| logD | -0.56 | pH 8;Mafana: 25 °C | (1) ACD |
| logD | -0.70 | pH 9;Mafana: 25 °C | (1) ACD |
| logD | -1.25 | pH 10;Mafana: 25 °C | (1) ACD |
| NY FANANANA | sarobidy | toe-javatra | Source |
| logP | -0,538±0,456 | Mafana: 25 °C | (1) ACD |
| Faobe Intrinsic Solubility | 4,9 g/L | Mafana: 25 °C | (1) ACD |
| Mass Solubility | 4,9 g/L | pH 1;Mafana: 25 °C | (1) ACD |
| Mass Solubility | 4,9 g/L | pH 2;Mafana: 25 °C | (1) ACD |
| Mass Solubility | 4,9 g/L | pH 3;Mafana: 25 °C | (1) ACD |
| Mass Solubility | 4,9 g/L | pH 4;Mafana: 25 °C | (1) ACD |
| Mass Solubility | 4,9 g/L | pH 5;Mafana: 25 °C | (1) ACD |
| Mass Solubility | 4,9 g/L | pH 6;Mafana: 25 °C | (1) ACD |
| Mass Solubility | 4,9 g/L | pH 7;Mafana: 25 °C | (1) ACD |
| Mass Solubility | 5,2 g/L | pH 8;Mafana: 25 °C | (1) ACD |
| Mass Solubility | 6,9 g/L | pH 9;Mafana: 25 °C | (1) ACD |
| Mass Solubility | 25 g/L | pH 10;Mafana: 25 °C | (1) ACD |
| Mass Solubility | 4,9 g/L | Rano tsy voaaro pH 5.53;Mafana: 25 °C | (1) ACD |
| Molar intrinsic solubility | 0,020 mol/L | Mafana: 25 °C | (1) ACD |
| Molar Solubility | 0,020 mol/L | pH 1;Mafana: 25 °C | (1) ACD |
| Molar Solubility | 0,020 mol/L | pH 2;Mafana: 25 °C | (1) ACD |
| Molar Solubility | 0,020 mol/L | pH 3;Mafana: 25 °C | (1) ACD |
| Molar Solubility | 0,020 mol/L | pH 4;Mafana: 25 °C | (1) ACD |
| Molar Solubility | 0,020 mol/L | pH 5;Mafana: 25 °C | (1) ACD |
| Molar Solubility | 0,020 mol/L | pH 6;Mafana: 25 °C | (1) ACD |
| Molar Solubility | 0,020 mol/L | pH 7;Mafana: 25 °C | (1) ACD |
| Molar Solubility | 0,021 mol/L | pH 8;Mafana: 25 °C | (1) ACD |
| Molar Solubility | 0,028 mol/L | pH 9;Mafana: 25 °C | (1) ACD |
| Molar Solubility | 0,10 mol/L | pH 10;Mafana: 25 °C | (1) ACD |
| Molar Solubility | 0,020 mol/L | Rano tsy voaaro pH 5.53;Mafana: 25 °C | (1) ACD |
| Lanja molekiola | 246.19 | ||
| pKa | 9.39±0.10 | Mafana asidra indrindra: 25 °C | (1) ACD |
(1) Kajy amin'ny alalan'ny Fampivoarana Chemistry Advanced (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| NY FANANANA | sarobidy | toe-javatra | Source |
| hakitroky | 1,63±0,1 g/cm3 | Mafana: 20 °C;Press: 760 Torr | (1) ACD |
| Boky molar | 150.8±5.0 cm3/mol | Mafana: 20 °C;Press: 760 Torr | (1) ACD |
(1) Kajy amin'ny alalan'ny Fampivoarana Chemistry Advanced (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| NY FANANANA | sarobidy | toe-javatra | Source |
| Fatorana azo ahodina malalaka | 4 | (1) ACD | |
| H Acceptors | 7 | (1) ACD | |
| H Mpanome | 3 | (1) ACD | |
| H Donor/Acceptor Sum | 10 | (1) ACD | |
| logP | -0,538±0,456 | Mafana: 25 °C | (1) ACD |
| Lanja molekiola | 246.19 |
(1) Kajy amin'ny alalan'ny Fampivoarana Chemistry Advanced (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| NY FANANANA | sarobidy | Loharanon'ny toe-javatra |
| Faritra ambonin'ny polar | 99.1 A2 | (1) ACD |
(1) Kajy amin'ny alalan'ny Fampivoarana Chemistry Advanced (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra misy
1 H NMR
13 C NMR
| Loharanon'ny fanambarana loza mitatao | |
| H228 mafy mirehitra | Fanasokajiana & fametahana marika Eoropeana Chemical Agency (ECHA). Inventory - Fanasokajiana sy fametahana fampandrenesana - fampandrenesana mahazatra indrindra, European Chemical Agency (ECHA) Fanasokajiana & fametahana marika - Fanasokajiana sy fametahana marika - fampandrenesana lehibe indrindra |
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