C17h17n5no5 adenosine, n-benzoyl- (7ci, 9ci, ACI) H333, H303, H303, H303
Key Force Properties | Kukosha | Mamiriro |
Sreek inoremerwa | 371.35 | - |
Inline point (kuyedza) | 152 ° C | - |
Density (yakafanotaurwa) | 1.70 ± 0.1 g / cm3 | Temp: 20 ° C; Press: 760 Torr |
PKA (akafanotaura) | 7.87 × 0.43 | Yakawanda Acadic Temp: 25 ° C |
Canonical Smiles O = C (NC1 = NC2 = CN2C3OC (Co) C (O) C3O) C = 4C = CC = CC4 CC4 CC = CC4 CC4 CC
Isomeric smiles o [c @ h] 1 [c @ h] 1 [c @2c = 3c (n = o) cc = cc = cn3
Ichi
Inchi = 1S / C17H17N5O5 / C23-10-6 (24) 13 (25) 17 (26-10-19-16 (11) 22) 21-16 (26) 9-16 (26) 9-16 (26) 9-16 (26) 9-16 (26) 9-16 (26) 9-16 (26) 23-25H, 6h2, (H, 18,19,21,26) / T10-, 12-, 17- / M1 / S1
Inchi kiyi
Nzdwtkfdauoda-cnemsgbdsa-n
Mamwe mazita echinhu ichi
Benzamide, N- (9-β-D-Ribofuranosyl-9h-Purin-6-yl) - (8000); N-Benzoyladenine (ACI); N6-Benzoyladenosine
Zvivakwa zviripo |
Thermal |
Thermal
Chivakwa | Kukosha | Mamiriro | Kunobva |
Inonyungudika | 152 ° C | (1) IC |
(1) Gopalakrishnan, vidhya; Kuenderera mberi - Indian Academy yesainzi, sainzi yemakemikari, (1989), 101 (5), 401-13, caplus
Spectra inowanikwa
1h Nmr
13c NMR
Hetero nmr
IR
Zvivakwa zviripo |
Biological |
CHEMICAL |
Density |
Lipininski |
Chimiro chakabatana |
Biological
Chivakwa | Kukosha | Mamiriro | Kunobva |
Bioconentice Factor | 1.0 | ph 1; Temp: 25 ° C | (1) ACD |
Bioconentice Factor | 1.83 | Ph 2; Temp: 25 ° C | (1) ACD |
Bioconentice Factor | 2,56 | Ph 3; Temp: 25 ° C | (1) ACD |
Bioconentice Factor | 2.67 | Ph 4; Temp: 25 ° C | (1) ACD |
Bioconentice Factor | 2.68 | Ph 5; Temp: 25 ° C | (1) ACD |
Bioconentice Factor | 2.65 | Ph 6; Temp: 25 ° C | (1) ACD |
Bioconentice Factor | 2.37 | Ph7; Temp: 25 ° C | (1) ACD |
Bioconentice Factor | 1.16 | Ph:; Temp: 25 ° C | (1) ACD |
Bioconentice Factor | 1.0 | Ph 9; Temp: 25 ° C | (1) ACD |
Bioconentice Factor | 1.0 | Ph 10; Temp: 25 ° C | (1) ACD |
.
CHEMICAL
Chivakwa | Kukosha | Mamiriro | Kunobva |
Koc | 12,6 | ph 1; Temp: 25 ° C | (1) ACD |
Koc | 48.2 | Ph 2; Temp: 25 ° C | (1) ACD |
Koc | 67.3 | Ph 3; Temp: 25 ° C | (1) ACD |
Koc | 70.1 | Ph 4; Temp: 25 ° C | (1) ACD |
Koc | 70.3 | Ph 5; Temp: 25 ° C | (1) ACD |
Koc | 69.5 | Ph 6; Temp: 25 ° C | (1) ACD |
Koc | 62.2 | Ph7; Temp: 25 ° C | (1) ACD |
Koc | 30.5 | Ph:; Temp: 25 ° C | (1) ACD |
Koc | 5.54 | Ph 9; Temp: 25 ° C | (1) ACD |
Koc | 1.22 | Ph 10; Temp: 25 ° C | (1) ACD |
Logd | 0.12 | ph 1; Temp: 25 ° C | (1) ACD |
Logd | 0.70 | Ph 2; Temp: 25 ° C | (1) ACD |
Logd | 0.85 | Ph 3; Temp: 25 ° C | (1) ACD |
Logd | 0.86 | Ph 4; Temp: 25 ° C | (1) ACD |
Logd | 0.87 | Ph 5; Temp: 25 ° C | (1) ACD |
Logd | 0.86 | Ph 6; Temp: 25 ° C | (1) ACD |
Logd | 0.81 | Ph7; Temp: 25 ° C | (1) ACD |
Logd | 0.50 | Ph:; Temp: 25 ° C | (1) ACD |
Logd | -0.24 | Ph 9; Temp: 25 ° C | (1) ACD |
Logd | -0.89 | Ph 10; Temp: 25 ° C | (1) ACD |
logp | 0.868 × 0.577 | Temp: 25 ° C | (1) ACD |
Misa intrinsic solubility | 0.037 G / L | Temp: 25 ° C | (1) ACD |
Misa Solubility | 0.22 g / l | ph 1; Temp: 25 ° C | (1) ACD |
Misa Solubility | 0.056 g / l | Ph 2; Temp: 25 ° C | (1) ACD |
Misa Solubility | 0.041 G / L | Ph 3; Temp: 25 ° C | (1) ACD |
Misa Solubility | 0.041 G / L | Ph 4; Temp: 25 ° C | (1) ACD |
Misa Solubility | 0.037 G / L | Ph 5; Temp: 25 ° C | (1) ACD |
Misa Solubility | 0.041 G / L | Ph 6; Temp: 25 ° C | (1) ACD |
Misa Solubility | 0.045 G / l | Ph7; Temp: 25 ° C | (1) ACD |
Misa Solubility | 0.089 g / l | Ph:; Temp: 25 ° C | (1) ACD |
Misa Solubility | 0.48 g / l | Ph 9; Temp: 25 ° C | (1) ACD |
Misa Solubility | 2.2 g / l | Ph 10; Temp: 25 ° C | (1) ACD |
Chivakwa | Kukosha | Mamiriro | Kunobva |
Misa Solubility | 0.041 G / L | Mvura isina kugadziriswa ph 5.93; Temp: 25 ° C | (1) ACD |
Molar Intrinsic Solubility | 1.0 x 10-4 Mol / l | Temp: 25 ° C | (1) ACD |
Moul solubility | 5.8 x 10-4 Mol / l | ph 1; Temp: 25 ° C | (1) ACD |
Moul solubility | 1.5 x 10-4 mol / l | Ph 2; Temp: 25 ° C | (1) ACD |
Moul solubility | 1.1 x 10-4 mol / l | Ph 3; Temp: 25 ° C | (1) ACD |
Moul solubility | 1.1 x 10-4 mol / l | Ph 4; Temp: 25 ° C | (1) ACD |
Moul solubility | 1.0 x 10-4 Mol / l | Ph 5; Temp: 25 ° C | (1) ACD |
Moul solubility | 1.1 x 10-4 mol / l | Ph 6; Temp: 25 ° C | (1) ACD |
Moul solubility | 1.2 x 10-4 Mol / l | Ph7; Temp: 25 ° C | (1) ACD |
Moul solubility | 2.4 x 10-4 Mol / l | Ph:; Temp: 25 ° C | (1) ACD |
Moul solubility | 1.3 x 10-3 mol / l | Ph 9; Temp: 25 ° C | (1) ACD |
Moul solubility | 6.0 x 10-3 mol / l | Ph 10; Temp: 25 ° C | (1) ACD |
Moul solubility | 1.1 x 10-4 mol / l | Mvura isina kugadziriswa ph 5.93; Temp: 25 ° C | (1) ACD |
Sreek inoremerwa | 371.35 | ||
Pka | 7.87 × 0.43 | Yakawanda Acadic Temp: 25 ° C | (1) ACD |
Pka | 1.39 ± 0.10 | Yakanyanya kukosha temp: 25 ° C | (1) ACD |
.
Density
Chivakwa | Kukosha | Mamiriro | Kunobva |
Density | 1.70 ± 0.1 g / cm3 | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
Malal vhoriyamu | 217.3 × 7.0 cm3 / mol | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
.
Lipininski
Chivakwa | Kukosha | Mamiriro | Kunobva |
Zvisikwa zvakasununguka zvinosununguka | 6 | (1) ACD | |
H Acceltors | 10 | (1) ACD | |
H Vanopa | 4 | (1) ACD | |
H Anopa / Mugamuchire Sum | 14 | (1) ACD | |
logp | 0.868 × 0.577 | Temp: 25 ° C | (1) ACD |
Sreek inoremerwa | 371.35 |
.
Chimiro chakabatana
Chivakwa | Kukosha | Mamiriro | Kunobva |
Polar Pource Area | 143 A2 | (1) ACD |
.
Spectra inowanikwa
1h Nmr
13c NMR
Kodhi | Thazard Chirevo | Kunobva |
H333 | Inogona kuve inokuvadza kana inhaled | Nyanzvi kuremerwa |
H303 | Inogona kunge iri kukuvadza kana yakamedzwa | Nyanzvi kuremerwa |
H302 | Zvinokuvadza kana wamedza | European Chemical Agency (Echa) Kugadziriswa kweKugadziriswa - Kuziviswa Kwekutsikisa - Kuzivikanwa Kwemaketi |
Regulatory Rondedzero: Kusvikira, TCS
Kuvimbika Bhizinesi Ruzivo: Ruzhinji
Regulatory Synonyms | ||
Adenosine, n-benzoyl- | Svitsa, TCS | - |
N- {9 - [(2r, 3: 4,4-demoxyDryoxy-5- (hydroxymfyl) oxolan-2-yl-purin-6-yl} benzamide | Svika | - |
N6-Benzoyladenosine | Svika | - |
Ruzivo neNyika / International & Zvimwe Zvinyorwa Nyika Nyika / Dunhu Ruzivo rwuripo
European Union Summary
Inventory mamiriro pane kusvika pane zvinyorwa zvakanyoreswa
https ::::::::::://acha.euuropa-inbstance-information/-/substanceinfo/100.132.658
Regulatory rondedzero nhamba yeCC kwete. 610-251-3
Taiwan Summary
Inventory Status paTCSI Taiwan Goverana Ga