![C53h66n7o8psi cas no.: 104992-55-4 adenosine, n-benzoyl-5 '-O- [2-MantexylSilyl] dimethylmylh] dimethylmylh Methylethyl) Phosphoramidite] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C53h66n7o8psi cas no.: 104992-55-4 adenosine, n-benzoyl-5 '-O- [2-MantexylSilyl] dimethylmylh] dimethylmylh Methylethyl) Gambar Fosphorosidite (ACI)](https://cdn.globalso.com/nvchem/C53H66N7O8PSi.png)
C53h66n7o8psi cas no.: 104992-55-4 adenosine, n-benzoyl-5 '-O- [2-MantexylSilyl] dimethylmylh] dimethylmylh Methylethyl) Phosphoramidite] (ACI)
Nomer Registri CAS
104992-55-4
| Properties fisik Key | Regane | Kondisi |
| Bobot molekuler | 988.19 | - |
| Pka (diprediksi) | 7.87 ± 0.43 | Temp paling asam: 25 ° C |
Mesem kanonik
N # CCCOP (OC1C (OC (OC (N2C = NC = 3C (= nc = nc) nc3 (c) (c6 = c6 = c6 = c6 = c6 = c6) c7 = c6) c7 = c6 Cc = c (oc) c = c7) n (c (c) c) c (c) c
Mesem isomerat
C (OC [C @@@ H] 1 [C @@ H] (n (c) c) (c) (n-) (c) (= o) c4 = cc) c4 = cc = cc = c4 = c4 = c4 N = cn3) (c5 = c5 = c (oc) c = c5) (c6 = c6 = c6 = c6 = c6) c7 = c6 = c7 = c7 = c7 = c7
INCI
Kopi = 1s / c53h66n7o8psi / c1-36 (2) 60 (37) 4) 69 (654-53-42 (65-23--42 (62-8) 28-24-40) 28-24-40 ) 41-25-29-29-43--43 (63-9) 30-26-41) 66-51 (47 (46) 68-70 (10,6) 5) 59-3-7-56-48 (45-3-57-48 (61) 38-19-14-12-15-20-14-12-15 2-17,19-30,444,44,4,4,4,4,4,4,4,4677,51h, 18,32-33h2,1-11h3, (H, 556,58,61) / T44-, 46-, 41-, 69, 69? / M1 / S1
Kunci inci
Ffxhncnnnnkhas-rfmfgjhusa-n
1 Jeneng liyane kanggo zat iki
Adenosine,N-Benzoyl-5 '-O- [bis (4-meteixyphenht) phenylmethyl] -2 '-O- [(1,1-Dimethylethyl) dimethylsilyl] -, 3 '- [2-syanoethyls BIS (1- metilethyl) fosphoramidite] (9Ci)
Spektrum kasedhiya
Massa
Properties kasedhiya
Biologis
Kimia
Lipinski
Struktur sing gegandhengan
| Properti | Regane | Kondisi | Sumber |
| Faktor biokentrasi | 5.50 x 105 | PH 1; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | PH 2; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | PH 3; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | pH 4; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | pH 5; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | pH 6; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | pH 7; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | PH 8; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | PH 9; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | PH 10; Temp: 25 ° C | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
| Properti | Regane | Kondisi | Sumber |
| Koc | 61500 | PH 1; Temp: 25 ° C | (1) ACD |
| Koc | 1.64 x 106 | PH 2; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | PH 3; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | pH 4; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | pH 5; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | pH 6; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | pH 7; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | PH 8; Temp: 25 ° C | (1) ACD |
| Koc | 3.20 x 106 | PH 9; Temp: 25 ° C | (1) ACD |
| Properti | Regane | Kondisi | Sumber |
| Koc | 9.24 x 105 | PH 10; Temp: 25 ° C | (1) ACD |
| logd | 8.81 | PH 1; Temp: 25 ° C | (1) ACD |
| logd | 10.24 | PH 2; Temp: 25 ° C | (1) ACD |
| logd | 11.24 | PH 3; Temp: 25 ° C | (1) ACD |
| logd | 11.73 | pH 4; Temp: 25 ° C | (1) ACD |
| logd | 11.83 | pH 5; Temp: 25 ° C | (1) ACD |
| logd | 11.83 | pH 6; Temp: 25 ° C | (1) ACD |
| logd | 11.75 | pH 7; Temp: 25 ° C | (1) ACD |
| logd | 11.31 | PH 8; Temp: 25 ° C | (1) ACD |
| logd | 10.53 | PH 9; Temp: 25 ° C | (1) ACD |
| logd | 9.99 | PH 10; Temp: 25 ° C | (1) ACD |
| logp | 11.845 ± 0.715 | Temp: 25 ° C | (1) ACD |
| Kelarutan Kelainan Intrinsik Massa | 1.2 x 10-5 g / l | Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 3,5 x 10-3 g / l | PH 1; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 1.1 x 10-4 g / l | PH 2; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 9.9 X 10-6 g / l | PH 3; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 3.4 x 10-6 g / l | pH 4; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 2.7 x 10-6 g / l | pH 5; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 2.7 x 10-6 g / l | pH 6; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 3.2 x 10-6 g / l | pH 7; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 8.9 x 10-6 g / l | PH 8; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 6,3 x 10-5 g / l | PH 9; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.2 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 3.2 x 10-6 g / l | Banyu banyu sing ora diluncurake 7.00; Temp: 25 ° C | (1) ACD |
| Kelarutan Kelaresan Inttrinsik Molar | 1.2 x 10-8 mol / l | Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 3,5 x 10-6 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 1.1 x 10-7 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 1.0 x 10-8 mol / l | PH 3; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 3.4 x 10-9 mol / l | pH 4; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 2.7 x 10-9 mol / l | pH 5; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 2.7 x 10-9 mol / l | pH 6; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 3.2 x 10-9 mol / l | pH 7; Temp: 25 ° C | (1) ACD |
| Properti | Regane | Kondisi | Sumber |
| Kelarutan molar | 9.0 x 10-9 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 6.4 x 10-8 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 4.2 x 10-7 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 3.2 x 10-9 mol / l | Banyu banyu sing ora diluncurake 7.00; Temp: 25 ° C | (1) ACD |
| Bobot molekuler | 988.19 | ||
| PKA | 7.87 ± 0.43 | Temp paling asam: 25 ° C | (1) ACD |
| PKA | 3.45 ± 070 | Umume Temp: 25 ° C | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
| Properti | Regane | Kondisi | Sumber |
| Obligasi kanthi bebas | 21 | (1) ACD | |
| H Nampa | 15 | (1) ACD | |
| H donor | 1 | (1) ACD | |
| H Donor / Sumrah Panampa | 16 | (1) ACD | |
| logp | 11.845 ± 0.715 | Temp: 25 ° C | (1) ACD |
| Bobot molekuler | 988.19 |
| Properti | Regane | Sumber kahanan |
| Area permukaan polar | 178 A2 | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Perangkat lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Labs)
Spektrum kasedhiya
1 h nmr
13 c nmr
