![C50H58N7O9P Adenosine, N-benzoyl-5′-O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – O-(2-methoxyethyl)-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl) phosphoramidite] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C50H58N7O9P Adenosine, N-benzoyl-5′-O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – O-(2-methoxyethyl)-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl) phosphoramidite] (ACI) Ìomhaigh Sònraichte](https://www.csnvchem.com/uploads/C50H58N7O9P-Adenosine.png)
C50H58N7O9P Adenosine, N-benzoyl-5′-O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – O-(2-methoxyethyl)-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl) phosphoramidite] (ACI)
Àireamh Clàraidh CAS
251647-53-7
H302
| Prìomh Thogalaichean Fiosaigeach | Luach | Suidheachadh |
| Cuideam Moileciuil | 932.01 | - |
| pKa (Ro-innse) | 7.87±0.43 | Teòthachd as searbhaiche: 25 °C |
Gàire Canònach
N#CCCOP(OC1C(OC(N2C=NC=3C(=NC=NC32)NC(=O)C=4C=CC=CC4)C1OCCOC)COC(C=5C=CC=CC5)(C6=CC=C(OC)C=C6)C7=CC=C(OC)C(C7)N(C)C
Gàire Isomeric
C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](OCCOC)[C@@H](O1)N2C=3C(N=C2)=C(NC(=O)C4=CC=CC=C4)N=CN3)(C5 =CC=C(OC)C=C5)(C6=CC=C(OC)C=C6)C7=CC=CC=C7
InChI
InChI= 1S/C50H58N7O9P/c1-34(2)57(35(3)4)67(64-28-14-27-51)66-44-42(31-63-50(37-17-12-9-13-18-37,38-19-23-40(60-6)24-20-38)3 9-21-25-41(61-7)26-22-39)65-49(45(44)62-30-29-59-5)56-33-54-43-46(52-32-53-47(43)56)55-48(58)36-15-10-8-11-16-36/u8-13,15-26, 32-35,42,44-45,49U,14,28-31U2,1-7U3,(U,52,53,55,58)/t42-,44-,45-,49-,67?/m1/s1
Iuchair InChI
VPBYBQBHLYRLHG-HDMAWCRFSA-N
16 Ainmean Eile airson an Stuff seo
Adenosine,N-beinsoil-5′ -O- [bis(4-methocsaiphenyl)phenylmethyl]-2′ -O-(2-meatocsa-eitile)-, 3′-[2-ciano-eitile bis(1-meitile-eitile)
fosfaramidait] (9CI); 16: PN: US20030211606 DUILLEAG: 19 sreath tagraidh; 16: PN: US20030212017 DUILLEAG: 20 sreath tagraidh; 17: PN: US20040005569 DUILLEAG: 22 sreath tagraidh; 19: PN: US20040006030 DUILLEAG: 23 sreath tagraidh; 19: PN: US20040014047
DUILLEAG: 21 sreath tagraidh; 19: PN: US20040014049 DUILLEAG: 21 sreath tagraidh; 20: PN: US20040005570 DUILLEAG: 20 tagraidh
sreath; 20: PN: US20040014048 DUILLEAG: 21 sreath tagraidh; 20: PN: US20040014050 DUILLEAG: 20 sreath tagraidh; 21: PN: U
S20040005565 DUILLEAG: 17- 22 sreath tagraidh; 21: PN: US20040014051 DUILLEAG: 23 sreath tagraidh; 22: PN: US20040014699 DUILLEAG: 20 sreath tagraidh; 23: PN: US20040006029 DUILLEAG: 23 sreath tagraidh; 23: PN: WO03106645 DUILLEAG: 73 sreath tagraidh; 94: P N: US20040005707 DUILLEAG: 20 sreath tagraidh
Speactra ri fhaighinn
1H NMR
13C NMR
NMR Hetero
Togalaichean a tha rim faighinn
Bith-eòlasach
Ceimigeach
Lipinski
Co-cheangailte ri Structar
| Seilbh | Luach | Suidheachadh | Stòr |
| Factar Bith-chruinneachaidh | 2680 | pH 1; Teòthachd: 25 °C | (1) ACD |
| Factar Bith-chruinneachaidh | 71500 | pH 2; Teòthachd: 25 °C | (1) ACD |
| Factar Bith-chruinneachaidh | 7.21 x 105 | pH 3; Teòthachd: 25 °C | (1) ACD |
| Factar Bith-chruinneachaidh | 1.00 x 106 | pH 4; Teòthachd: 25 °C | (1) ACD |
| Factar Bith-chruinneachaidh | 1.00 x 106 | pH 5; Teòthachd: 25 °C | (1) ACD |
| Factar Bith-chruinneachaidh | 1.00 x 106 | pH 6; Teòthachd: 25 °C | (1) ACD |
| Factar Bith-chruinneachaidh | 1.00 x 106 | pH 7; Teòthachd: 25 °C | (1) ACD |
| Factar Bith-chruinneachaidh | 8.48 x 105 | pH 8; Teòthachd: 25 °C | (1) ACD |
| Factar Bith-chruinneachaidh | 1.39 x 105 | pH 9; Teòthachd: 25 °C | (1) ACD |
| Factar Bith-chruinneachaidh | 40300 | pH 10; Teòthachd: 25 °C | (1) ACD |
(1) Air obrachadh a-mach le bhith a’ cleachdadh bathar-bog Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Seilbh | Luach | Suidheachadh | Stòr |
| Còc | 1360 | pH 1; Teòthachd: 25 °C | (1) ACD |
| Còc | 36300 | pH 2; Teòthachd: 25 °C | (1) ACD |
| Còc | 3.66 x 105 | pH 3; Teòthachd: 25 °C | (1) ACD |
| Còc | 1.13 x 106 | pH 4; Teòthachd: 25 °C | (1) ACD |
| Seilbh | Luach | Suidheachadh | Stòr |
| Còc | 1.42 x 106 | pH 5; Teòthachd: 25 °C | (1) ACD |
| Còc | 1.42 x 106 | pH 6; Teòthachd: 25 °C | (1) ACD |
| Còc | 1.17 x 106 | pH 7; Teòthachd: 25 °C | (1) ACD |
| Còc | 4.30 x 105 | pH 8; Teòthachd: 25 °C | (1) ACD |
| Còc | 70800 | pH 9; Teòthachd: 25 °C | (1) ACD |
| Còc | 20500 | pH 10; Teòthachd: 25 °C | (1) ACD |
| logD | 5.77 | pH 1; Teòthachd: 25 °C | (1) ACD |
| logD | 7.20 | pH 2; Teòthachd: 25 °C | (1) ACD |
| logD | 8.20 | pH 3; Teòthachd: 25 °C | (1) ACD |
| logD | 8.69 | pH 4; Teòthachd: 25 °C | (1) ACD |
| logD | 8.79 | pH 5; Teòthachd: 25 °C | (1) ACD |
| logD | 8.79 | pH 6; Teòthachd: 25 °C | (1) ACD |
| logD | 8.71 | pH 7; Teòthachd: 25 °C | (1) ACD |
| logD | 8.27 | pH 8; Teòthachd: 25 °C | (1) ACD |
| logD | 7.49 | pH 9; Teòthachd: 25 °C | (1) ACD |
| logD | 6.95 | pH 10; Teòthachd: 25 °C | (1) ACD |
| logP | 8.803±0.766 | Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Intrinsic Tomad | 5.4 x 10-5 g/L | Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd mais | 0.051 g/L | pH 1; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd mais | 1.9 x 10-3 g/L | pH 2; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd mais | 1.9 x 10-4 g/L | pH 3; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd mais | 6.0 x 10-5 g/L | pH 4; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd mais | 4.8 x 10-5 g/L | pH 5; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd mais | 4.8 x 10-5 g/L | pH 6; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd mais | 5.8 x 10-5 g/L | pH 7; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd mais | 1.6 x 10-4 g/L | pH 8; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd mais | 9.3 x 10-4 g/L | pH 9; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd mais | 3.6 x 10-3 g/L | pH 10; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd mais | 5.7 x 10-5 g/L | Uisge gun bhùfradh pH 6.97; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Intrinsic Molar | 5.8 x 10-8 mol/L | Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Mhòlar | 5.5 x 10-5 mol/L | pH 1; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Mhòlar | 2.0 x 10-6 mol/L | pH 2; Teòthachd: 25 °C | (1) ACD |
| Seilbh | Luach | Suidheachadh | Stòr |
| So-sgaoilteachd Mhòlar | 2.0 x 10-7 mol/L | pH 3; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Mhòlar | 6.4 x 10-8 mol/L | pH 4; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Mhòlar | 5.1 x 10-8 mol/L | pH 5; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Mhòlar | 5.1 x 10-8 mol/L | pH 6; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Mhòlar | 6.2 x 10-8 mol/L | pH 7; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Mhòlar | 1.7 x 10-7 mol/L | pH 8; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Mhòlar | 1.0 x 10-6 mol/L | pH 9; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Mhòlar | 3.9 x 10-6 mol/L | pH 10; Teòthachd: 25 °C | (1) ACD |
| So-sgaoilteachd Mhòlar | 6.1 x 10-8 mol/L | Uisge gun bhùfradh pH 6.97; Teòthachd: 25 °C | (1) ACD |
| Cuideam Moileciuil | 932.01 | ||
| pKa | 7.87±0.43 | Teòthachd as searbhaiche: 25 °C | (1) ACD |
| pKa | 3.45±0.70 | Teòthachd as Bunasaiche: 25 °C | (1) ACD |
(1) Air obrachadh a-mach le bhith a’ cleachdadh bathar-bog Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Seilbh | Luach | Suidheachadh | Stòr |
| Ceanglaichean a ghabhas rothladh gu saor | 22 | (1) ACD | |
| Gabhadairean H | 16 | (1) ACD | |
| Luchd-tabhartais H | 1 | (1) ACD | |
| Suim Tabhartaiche/Gabhadair H | 17 | (1) ACD | |
| logP | 8.803±0.766 | Teòthachd: 25 °C | (1) ACD |
| Cuideam Moileciuil | 932.01 |
(1) Air obrachadh a-mach le bhith a’ cleachdadh bathar-bog Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Seilbh | Luach | Stòr an t-suidheachaidh |
| Raon Uachdar Pòlach | 187 A2 | (1) ACD |
(1) Air obrachadh a-mach le bhith a’ cleachdadh bathar-bog Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Speactra ri fhaighinn
1H NMR
13C NMR
| Còd Aithris Cunnart Stòr | |
| H302 Cronail ma shluigear e | Seòrsachadh is Lipéadachadh Buidheann Cheimigeach na h-Eòrpa (ECHA) Clàr-stuthan - Seòrsachadh agus bileagan air an cur an cèill - na fiosan as cumanta, Buidheann Cheimigeach na h-Eòrpa (ECHA) Clàr-seòrsachaidh is bileagan - Seòrsachadh is bileagan air an cur an cèill - na fiosan as cudromaiche |
![C40H49N4O9P Uridine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-methyl-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidine] (ACI)](https://www.csnvchem.com/uploads/C40H49N4O9P-Uridine-300x300.png)
![C41H49FN5O8P Cytidine, N-acetyl-5′-O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – deoxy-2′-fluoro-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphor amidite] (ACI)](https://www.csnvchem.com/uploads/C41H49FN5O8P-Cytidine-300x300.png)
![C47H51FN7O7P Adenosine, N-benzoyl-5′-O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – deoxy-2′-fluoro-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphor amidite] (ACI)](https://www.csnvchem.com/uploads/C47H51FN7O7P-Adenosine-300x300.png)
![C50H60N5O10P Cytidine, N-benzoyl-5′-O- [bis(4-methoxyphenyl)phenylmethyl]-2′-O- (2-methoxyethyl)- 5-methyl-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl) phosphoramidite] (ACI)](https://www.csnvchem.com/uploads/C50H60N5O10P-Cytidine-300x300.png)
![C43H55N4O10P Uridine, 5′ -O- [bis(4-methocsaiphenyl)phenylmethyl]-2′ -O-(2-methocsaiethyl)-5-methyl-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphor amidite] (ACI)](https://www.csnvchem.com/uploads/C43H55N4O10P-Uridine-300x300.png)
![C42H52N5O9P Cytidine, N-acetyl-5′-O- [bis(4-methoxyphenyl)phenylmethyl]-2′-O- methyl-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidine] (ACI)](https://www.csnvchem.com/uploads/C42H52N5O9P-Cytidine-300x300.png)