C17h17N5o5 Adenosine, N-Benzoyl- (7ci, 9ci, ACI) H333, H303, H303
| Izakhiwo ezisemqoka ezisemqoka | Thanda | Into efunekayo |
| Isisindo molecular | 371.35 | - |
| Iphoyinti Lokuncibilika (Ukuhlola) | I-152 ° C | - |
| Ubuningi (obubikezelwe) | 1.70 ± 0.1 g / cm3 | I-Temp: 20 ° C; Cindezela: 760 Torr |
| I-PKA (ebikezelwe) | 7.87 ± 0.43 | Iningi le-acid temp: 25 ° C |
Ukumamatheka kwe-canonical O = C (NC1 = NC = NC2 = C1N = CN2C3OC (co) c (4C = CC = CC4
I-Isomeric Smiles O [C @]
Inchi
Inch = 1s / c17h17N5o5 / C23-6-10-12 (25) 13 (25) 13 (27) 21 (27-2) 22 (27-10) 22- 18-2) 9-16-16-15 (18- 2-2-3-3 (2-2-3-3-3,12-13,12-13,12-13,17,12-13,17, 23-25h, 6h2, (H, 18,19,21,26) / T10-, 12-, 13-, 17- / M1 / S1 / S1
Ukhiye we-inchi
Nzdwkffdauoda-cnemsgbsa-n
Amanye amagama ama-3 ngale nto
Benzomide, n- (9-β-d-ribofuranosyl-9h-purin-6-yl) - (8ci); N-benzoyladenosine (ACI); N6-benzoyladenosine
| Izakhiwo zitholakala |
| Impamba |
Impamba
| Impahla | Thanda | Into efunekayo | Umthombo |
| Iphuzu elincibilikayo | I-152 ° C | (1) IC | |
(1) IGopalakrishnan, vidhya; Ukuchuma - I-Indian Academy of Science, I-Chemical Science, (1989), 101 (5), 401-13, CALPUS
I-Spectra iyatholakala
1h NMR
I-13c NMR
Hetero nmr
IR
| Izakhiwo zitholakala |
| Bitionalogical |
| Okuthakiweyo |
| Incekusana |
| Lipinski |
| Isakhiwo esihlobene |
Bitionalogical
| Impahla | Thanda | Into efunekayo | Umthombo |
| Isici se-BioConCentration | 1.0 | ph 1; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-1.83 | I-PH 2; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-2.56 | I-PH 3; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-2.67 | I-PH 4; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-2.68 | I-PH 5; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-2.65 | I-PH 6; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-2.37 | I-PH 7; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | 1.16 | I-PH 8; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | 1.0 | I-PH 9; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | 1.0 | ph 10; Temp: 25 ° C | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Okuthakiweyo
| Impahla | Thanda | Into efunekayo | Umthombo |
| Ibhola | 12.6 | ph 1; Temp: 25 ° C | (1) ACD |
| Ibhola | 48.2 | I-PH 2; Temp: 25 ° C | (1) ACD |
| Ibhola | 67.3 | I-PH 3; Temp: 25 ° C | (1) ACD |
| Ibhola | 70.1 | I-PH 4; Temp: 25 ° C | (1) ACD |
| Ibhola | 70.3 | I-PH 5; Temp: 25 ° C | (1) ACD |
| Ibhola | 69.5 | I-PH 6; Temp: 25 ° C | (1) ACD |
| Ibhola | 62.2 | I-PH 7; Temp: 25 ° C | (1) ACD |
| Ibhola | 30.5 | I-PH 8; Temp: 25 ° C | (1) ACD |
| Ibhola | 5.54 | I-PH 9; Temp: 25 ° C | (1) ACD |
| Ibhola | 1.22 | ph 10; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | 0.12 | ph 1; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | 0.70 | I-PH 2; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | 0.85 | I-PH 3; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | 0.86 | I-PH 4; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | 0.87 | I-PH 5; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | 0.86 | I-PH 6; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | 0.81 | I-PH 7; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | 0.50 | I-PH 8; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | -0.24 | I-PH 9; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | -0.89 | ph 10; Temp: 25 ° C | (1) ACD |
| ngena ngemvume | 0.868 ± 0.577 | Temp: 25 ° C | (1) ACD |
| I-SAST ENTINSIC SOLUBLIC | 0.037 g / l | Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.22 g / l | ph 1; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.056 g / l | I-PH 2; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.041 g / l | I-PH 3; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.041 g / l | I-PH 4; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.037 g / l | I-PH 5; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.041 g / l | I-PH 6; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.045 g / l | I-PH 7; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.089 g / l | I-PH 8; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.48 g / l | I-PH 9; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 2.2 g / l | ph 10; Temp: 25 ° C | (1) ACD |
| Impahla | Thanda | Into efunekayo | Umthombo |
| Inqwaba ye-solubility | 0.041 g / l | Amanzi angafakwanga i-PH 5.93; Temp: 25 ° C | (1) ACD |
| I-molar intrinsic soubility | 1.0 x 10-4 mol / l | Temp: 25 ° C | (1) ACD |
| Molar solility | 5.8 x 10-4 mol / l | ph 1; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.5 x 10-4 mol / l | I-PH 2; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.1 x 10-4 mol / l | I-PH 3; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.1 x 10-4 mol / l | I-PH 4; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.0 x 10-4 mol / l | I-PH 5; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.1 x 10-4 mol / l | I-PH 6; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.2 x 10-4 mol / l | I-PH 7; Temp: 25 ° C | (1) ACD |
| Molar solility | 2.4 x 10-4 mol / l | I-PH 8; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.3 x 10-3 mol / l | I-PH 9; Temp: 25 ° C | (1) ACD |
| Molar solility | 6.0 x 10-3 mol / l | ph 10; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.1 x 10-4 mol / l | Amanzi angafakwanga i-PH 5.93; Temp: 25 ° C | (1) ACD |
| Isisindo molecular | 371.35 | ||
| i-pka | 7.87 ± 0.43 | Iningi le-acid temp: 25 ° C | (1) ACD |
| i-pka | 1.39 ± 0.10 | I-TEMP eyisisekelo Eyisisekelo: 25 ° C | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Incekusana
| Impahla | Thanda | Into efunekayo | Umthombo |
| Incekusana | 1.70 ± 0.1 g / cm3 | I-Temp: 20 ° C; Cindezela: 760 Torr | (1) ACD |
| Ivolumu ye-motal | 217.3 ± 7.0 CM3 / Mol | I-Temp: 20 ° C; Cindezela: 760 Torr | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Lipinski
| Impahla | Thanda | Into efunekayo | Umthombo |
| Amabhondi ajikeleze ngokukhululeka | 6 | (1) ACD | |
| Akwamukela | 10 | (1) ACD | |
| H | 4 | (1) ACD | |
| H Donor / ukwamukela inani | 14 | (1) ACD | |
| ngena ngemvume | 0.868 ± 0.577 | Temp: 25 ° C | (1) ACD |
| Isisindo molecular | 371.35 |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Isakhiwo esihlobene
| Impahla | Thanda | Into efunekayo | Umthombo |
| Indawo yePolar Surface | 143 A2 | (1) ACD | |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
I-Spectra iyatholakala
1h NMR
I-13c NMR
| Ukufingqwa | Isitatimende Sobungozi | Umthombo |
| H333 | Kungaba yingozi uma kufakwa ngaphakathi | Isazi sakhula |
| H303 | Kungaba yingozi uma ukugwinywa | Isazi sakhula |
| H302 | Kuyingozi uma ugwinywa | Ukuhlukaniswa Kwamakhemikhali E-European Agency (ECHA) & I-Labeng Inventory - Ukuhlukaniswa Kwaziswa - Ukufakwa Kwamalebula - Izaziso ezivamile, Ukufakwa Kwamabhantshi - Ukufakwa Kwamalebula - Izaziso Ezibucayi kakhulu |
Uhlu Lokulawula: Finyelela, TCSI
Imininingwane yebhizinisi eliyimfihlo: umphakathi
| Izimboniso zokulawula | ||
| I-Adenosine, N-Benzoyl- | Finyelela, TCSI | - |
| N- {9 - [2r, 3r, 4s, 5r) -3,4-dihydroxy-5- (hydroxymethyl) oxholan-2-yl] -9h} }hh-}} | Fika | - |
| N6-benzoyladenosine | Fika | - |
Imininingwane yezwe / International kanye nolunye uhlu lwamazwe / imininingwane yesifunda iyatholakala
Isifinyezo se-European Union
Isimo sokusungula kuhlu lokufinyelela kwezinto ezibhalisiwe
https://echa.europa.eu/substance-orfformation/-/substancenfo/100.132.658
Uhlu Lokulawula Inombolo Ec No: 610-251-3
Isifinyezo saseTaiwan
Isimo sokusungula ku-TCSI Taiwan uhulumeni ga
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