C17h7o5 Edenesinen, N-Benzoyl- (7ci, Aci) H333, H333, H302, H302, H302, H302, H302, H302, H302, H302, H302, H302
Thepa ea bohlokoa ea 'mele | Boleng | Boemo |
Boima ba Molecular | 371.35 | - |
Ntlha ea ho qhibiliha (liteko) | 152 ° C | - |
Mabenyane (a boletsoeng esale pele) | 1.70 ± 0.1 g / cm3 | Temp: 20 ° C; Tobetsa: 760 Torr |
pka (e boletsoeng esale pele) | 7.87 ± 0.43 | Boholo ba tempele ea acidic: 25 ° C |
Cannonical Smiles O = C (NC1 = NC1 = NC2 = C1N = C1N = CN2C3OC (CC4 = CC4 = CC4 = CC4 = CC4 = CC4
Isomeric Smises o [C @ h] 1 [C @ h] (N2c = 3c (N = C. (NC3)
Inchi
Inchi = 1S / c1y17O5 / c23-6-10-12 (25) 17) 21) 9-40,12,12,14 23-25h, 6h2, (H, (H, 18,21,21,21,21) / t10-, 12-, 13- / S1
Senotlolo sa Inchi
Nzdwtkfdauoda-cnemsgbdsa-n
Mabitso a mang a 3 bakeng sa ntho ena
Benzamide, N- (9-β-D-D-ribofuranosyl-9h-Prinsi-6-yl) - (8ci); N-Benzoyladen (aci); N6-Benzoyladenesinesen
Thepa e fumanehang |
Armal |
Armal
Thepa | Boleng | Boemo | Mohloli |
Ntlha ea ho qhibiliha | 152 ° C | (1) IC |
(1) Gopakrishnan, Vidhya; Lintšing - India ka Setsi sa Machaena, Mahlale a lik'hemik'hale, (1981), 101 (51-13, callus
Spectra e fumanehang
1h nmr
13c nmr
Hetero nmr
IR
Thepa e fumanehang |
Sa tlhaho |
Lik'hemik'hale |
Letsoalo |
LIPINSSKI |
Sebopeho se amanang le |
Sa tlhaho
Thepa | Boleng | Boemo | Mohloli |
Linkho tsa BioCentration | 1.0 | ph 1; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 1.83 | ph 2; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2.56 | ph 3; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2.67 | PH 4; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2.68 | ph 5; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2.65 | PH 6; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2.37 | PH 7; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 1.16 | PH 8; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 1.0 | ph 9; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 1.0 | ph 10; TEMP: 25 ° C | (1) ACD |
.
Lik'hemik'hale
Thepa | Boleng | Boemo | Mohloli |
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 | PH 7; TEMP: 25 ° C | (1) ACD |
Koc | 30.5 | PH 8; 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 | PH 7; TEMP: 25 ° C | (1) ACD |
logd | 0.50 | PH 8; 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 |
Mass Interrincic solubility | 0.037 g / l | TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 0.22 g / l | ph 1; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 0.056 g / l | ph 2; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 0.041 g / l | ph 3; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 0.041 g / l | PH 4; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 0.037 g / l | ph 5; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 0.041 g / l | PH 6; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 0.045 g / l | PH 7; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 0.089 g / l | PH 8; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 0.48 g / l | ph 9; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 2.2 g / l | ph 10; TEMP: 25 ° C | (1) ACD |
Thepa | Boleng | Boemo | Mohloli |
Mass Slisedity | 0.041 g / l | Ph ea metsi e sa sebetsoang ph 5.93; TEMP: 25 ° C | (1) ACD |
Molala oa Molala oa Molala | 1.0 x 10-4 mol / l | TEMP: 25 ° C | (1) ACD |
Molala ea lla | 5.8 x 10-4 mol / l | ph 1; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.5 x 10-4 mol / l | ph 2; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.1 x 10-4 mol / L | ph 3; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.1 x 10-4 mol / L | PH 4; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.0 x 10-4 mol / l | ph 5; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.1 x 10-4 mol / L | PH 6; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.2 x 10-4 mol / l | PH 7; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 2.4 x 10-4 mol / l | PH 8; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.3 x 10-3 mol / L | ph 9; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.0 x 10-3 mol / L | ph 10; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 1.1 x 10-4 mol / L | Ph ea metsi e sa sebetsoang ph 5.93; TEMP: 25 ° C | (1) ACD |
Boima ba Molecular | 371.35 | ||
pka | 7.87 ± 0.43 | Boholo ba tempele ea acidic: 25 ° C | (1) ACD |
pka | 1.39 ± 0.10 | Boholo ba mosebetsi oa mantlha: 25 ° C | (1) ACD |
.
Letsoalo
Thepa | Boleng | Boemo | Mohloli |
Letsoalo | 1.70 ± 0.1 g / cm3 | Temp: 20 ° C; Tobetsa: 760 Torr | (1) ACD |
Molumo oa Molalar | 217.3 ± 7.0 cm3 / mol | Temp: 20 ° C; Tobetsa: 760 Torr | (1) ACD |
.
LIPINSSKI
Thepa | Boleng | Boemo | Mohloli |
Li-litlama tse potolohileng ka bolokolohi | 6 | (1) ACD | |
H | 10 | (1) ACD | |
H donors | 4 | (1) ACD | |
H donor / Canot | 14 | (1) ACD | |
Logp | 0.868 ± 0.577 | TEMP: 25 ° C | (1) ACD |
Boima ba Molecular | 371.35 |
.
Sebopeho se amanang le
Thepa | Boleng | Boemo | Mohloli |
Sebaka sa polar. | 143 A2 | (1) ACD |
.
Spectra e fumanehang
1h nmr
13c nmr
Khoutu | Polelo ea kotsi | Mohloli |
H333 | E kanna ea ba kotsi haeba e opeloa | Setsebi se ile sa khoptjoa |
H303 | E kanna ea ba kotsi haeba e metsoa | Setsebi se ile sa khoptjoa |
H302 | E kotsi haeba e metsoa | Setsi sa Europe sa Europe ea Europe (ECHA) Sekheo sa Bo-'mè le Labeding le ho ngolisa |
Lenane la Regge: Fihlisa, TCSI
Tlhahisoleseling ea lekunutu ea lekunutu: Sechaba
Synonyms | ||
Adenisine, N-Benzoyl- | Fihlella, TCSi | - |
N- {9 - [(2r, 4r, 4R, 5r) -3,4-diydroxy-5 - hydroxymes-2-yl]-6 | Fihlella | - |
N6-Benzoyladenesinesen | Fihlella | - |
Lintlha tse fanoeng ke naha / machabeng le ka manane a mang a manyane
Karolo ea European Union
Boemo ba TOPTY ho lethathamo la lintho tse ngolisitsoeng
https://echa.euuropa.eu/substance-
Lenane la lethathamo la lethathamo la nomoro ea hau che .: 610-251-3
Kakaretso ea Taiwan
Boemo ba lethathamo la TCSI Taiwan Mmuso Ga