C20H23N5O6 Adenosine, N-Benzoyl-2'-o- (2-athoxyetyl) - (9CI, ACI)
Nga taonga tinana matua | Wāriu | Āhuatanga |
Taumaha Momo | 429.43 | - |
Te mutunga (tohua) | 1.53 ± 0.1 g / cm3 | TOM: 20 ° C; Press: 760 Torr |
PK (tohua) | 13.15 ± 0.70 | Te nuinga o te Opeware: 25 ° C |
SMILSICAL CLAMES O = C (NC1 = NC = NC2 = CN2C3OC (CN2C3OC (CNS2C3OC (CNS2C3OC (CCACCOC) C = 4C = CC4
He ataata isomeric o (ccoc) [c @ h] 1 [c @ h] (o @ h] (c @ h] (c @.
Hapani
Inchi = 1s / C20H23N5O6 / C1-29-7-8-30 (27) 13 (9) 13-20 (16) 25) 25-19 (H2-6,1 0-11,13,13-16-16,20,26-22, 7-9H2,1H3, (h, 21,22,22,28,28) / T13-, 16-, 20-, 20-,
Inchi Key
Rufjmcsvnngzfb-khtyjdqrssa-n
2 etahi atu ingoa mo tenei taonga
N-Benzoyl-2'-o- (2-athoxyethyl) Adenosine (Aci); N6-benzoyl-2'-o- (2-athoxyethyl) Adenosine
E waatea ana te Spectra
1h nmr
13c nmr
Nga Taonga e waatea ana |
Pāpori |
Matū |
Tōnu |
Lipinski |
Hanganga |
Pāpori
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te take koiora | 3.71 | Ph 1; Top: 25 ° C | (1) ACD |
Te take koiora | 14.6 | ph 2; Top: 25 ° C | (1) ACD |
Te take koiora | 20.9 | wh 3; Top: 25 ° C | (1) ACD |
Te take koiora | 21.8 | ph 4; Top: 25 ° C | (1) ACD |
Te take koiora | 21.9 | A 5; Top: 25 ° C | (1) ACD |
Te take koiora | 21.8 | ph 6; Top: 25 ° C | (1) ACD |
Te take koiora | 21.4 | A 7; Top: 25 ° C | (1) ACD |
Te take koiora | 17.6 | A 8; Top: 25 ° C | (1) ACD |
Te take koiora | 6.52 | A 9; Top: 25 ° C | (1) ACD |
Te take koiora | 1.08 | ph 10; Top: 25 ° C | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Matū
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Hononga | 53.2 | Ph 1; Top: 25 ° C | (1) ACD |
Hononga | 210 | ph 2; Top: 25 ° C | (1) ACD |
Hononga | 299 | wh 3; Top: 25 ° C | (1) ACD |
Hononga | 312 | ph 4; Top: 25 ° C | (1) ACD |
Hononga | 314 | A 5; Top: 25 ° C | (1) ACD |
Hononga | 313 | ph 6; Top: 25 ° C | (1) ACD |
Hononga | 306 | A 7; Top: 25 ° C | (1) ACD |
Hononga | 253 | A 8; Top: 25 ° C | (1) ACD |
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Hononga | 93.5 | A 9; Top: 25 ° C | (1) ACD |
Hononga | 15.5 | ph 10; Top: 25 ° C | (1) ACD |
arotau | 1.30 | Ph 1; Top: 25 ° C | (1) ACD |
arotau | 1.90 | ph 2; Top: 25 ° C | (1) ACD |
arotau | 2.05 | wh 3; Top: 25 ° C | (1) ACD |
arotau | 2.07 | ph 4; Top: 25 ° C | (1) ACD |
arotau | 2.07 | A 5; Top: 25 ° C | (1) ACD |
arotau | 2.07 | ph 6; Top: 25 ° C | (1) ACD |
arotau | 2.06 | A 7; Top: 25 ° C | (1) ACD |
arotau | 1.98 | A 8; Top: 25 ° C | (1) ACD |
arotau | 1.54 | A 9; Top: 25 ° C | (1) ACD |
arotau | 0.76 | ph 10; Top: 25 ° C | (1) ACD |
arotau | 2.085 ± 0.689 | Top: 25 ° C | (1) ACD |
Ko te whakaraeraetanga o te papatipu | 0.030 g / l | Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 0.17 g / l | Ph 1; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 0.0429 g / l | ph 2; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 0.030 g / l | wh 3; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 0.029 g / l | ph 4; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 0.029 g / l | A 5; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 0.029 g / l | ph 6; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 0.029 g / l | A 7; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 0.036 g / l | A 8; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 0.094 g / l | A 9; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 0.60 g / l | ph 10; Top: 25 ° C | (1) ACD |
Te whakarewa papatipu | 0.029 g / l | Unbuffed wai pH 6.38; Top: 25 ° C | (1) ACD |
Ko te ngoikoretanga o te kolarsic | 7.0 x 10-5 mol / l | Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 3.9 x 10-4 mol / l | Ph 1; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 1.00 x 10-4 mol / l | ph 2; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 7.0 x 10-5 mol / l | wh 3; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 6.7 x 10-5 mol / l | ph 4; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 6.7 x 10-5 mol / l | A 5; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 6.7 x 10-5 mol / l | ph 6; Top: 25 ° C | (1) ACD |
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te whakararatanga a Molar | 6.8 x 10-5 mol / l | A 7; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 8.3 x 10-5 mol / l | A 8; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 2.2 x 10-4 mol / l | A 9; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 1.4 x 10-3 mol / l | ph 10; Top: 25 ° C | (1) ACD |
Te whakararatanga a Molar | 6.7 x 10-5 mol / l | Unbuffed wai pH 6.38; Top: 25 ° C | (1) ACD |
Taumaha Momo | 429.43 | ||
pāt | 13.15 ± 0.70 | Te nuinga o te Opeware: 25 ° C | (1) ACD |
pāt | 8.80 ± 0.10 | Te tino tauira taketake: 25 ° C | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Tōnu
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Tōnu | 1.53 ± 0.1 g / cm3 | TOM: 20 ° C; Press: 760 Torr | (1) ACD |
Rōnga MOAR | 280.3 ± 7.0 cm3 / mol | TOM: 20 ° C; Press: 760 Torr | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Lipinski
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Nga here hurihuri noa | 9 | (1) ACD | |
H whakaae | 11 | (1) ACD | |
Ko nga putea | 3 | (1) ACD | |
H Donor / Whakaaetanga moni | 14 | (1) ACD | |
arotau | 2.085 ± 0.689 | Top: 25 ° C | (1) ACD |
Taumaha Momo | 429.43 |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
Hanganga
Rawa | Wāriu | Āhuatanga | Mātāpuna |
Te rohe mata o te polar | 141 A2 | (1) ACD |
(1) te whakamahi i te whakamahi i te Rorohiko Whakawhanake Matū (ACD / Labs) rorohiko v11.02 (© 1994-2023 ACD / Labs)
E waatea ana te Spectra
1h nmr
13c nmr