![C31H32N2O8-uridin, 5'-O-O-[Bis (4-metoxifenyl) fenylmetyl] -2'-O-metyl- (9C I, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C31H32N2O8-uridin, 5'-O-O-[Bis (4-metoxifenyl) fenylmetyl] -2'-O-metyl- (9C I, ACI) presenterade bild](https://cdn.globalso.com/nvchem/C31H32N2O8-Uridine.jpg)
C31H32N2O8-uridin, 5'-O-O-[Bis (4-metoxifenyl) fenylmetyl] -2'-O-metyl- (9C I, ACI)
| Viktiga fysiska egenskaper | Värde | Skick |
| Molekylvikt | 560.60 | - |
| Densitet (förutspådd) | 1,35 ± 0,1 g/cm3 | Temp: 20 ° C; Press: 760 Torr |
| PKA (förutspådd) | 9.39 ± 0,10 | Mest sura temp: 25 ° C |
Kanoniska leenden O = C1C = CN (C (= O) N1) C2OC (COC (C = 3C = CC = CC3) (C4 = CC = C (OC) C = C4) C5 = CC = C (OC) C = C5) C (O) C2OC
Isomeric SMILES C(OC[C@H]1O[C@H]([C@H](OC)[C@@H]1O)N2C(=O)NC(=O)C=C2)(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
Tum
Tum = 1S/C31H32N2O8/C1-37-23-13-9-21 (10-14-23) 31 (20-7-5-4-6-8-20,22-11-15-24 (38-2) 16-12-22) 40-19-25-27 (35) 28 (39-3) 29 (41-25)
33-18-17-26 (34) 32-30 (33) 36/H4-18,25,27-29,35H, 19H2,1-3H3, (H, 32,34,36)/T25-, 27-, 28-, 29-/M1/S1
Inchi -nyckel
MfdHavfjdSrpkc-yxinzvnlsa-n
2 andra namn för detta ämne
5'-O-O-[BIS (4-metoxifenyl) fenylmetyl] -2'-O-metyluridin (ACI); 5'-O- (4,4'-dimetoxytrityl) -2'-O-metyluridin
Spektra tillgängligt
1H NMR
Massa
| Egenskaper tillgängliga |
| Biologisk |
| Kemisk |
| Densitet |
| Lipinski |
| Strukturrelaterad |
Biologisk
| Egendom | Värde | Skick | Källa |
| Biokoncentrationsfaktor | 1240 | pH 1; Temp: 25 ° C | (1) ACD |
| Biokoncentrationsfaktor | 1240 | ph 2; Temp: 25 ° C | (1) ACD |
| Biokoncentrationsfaktor | 1240 | pH 3; Temp: 25 ° C | (1) ACD |
| Biokoncentrationsfaktor | 1240 | pH 4; Temp: 25 ° C | (1) ACD |
| Biokoncentrationsfaktor | 1240 | pH 5; Temp: 25 ° C | (1) ACD |
| Biokoncentrationsfaktor | 1240 | pH 6; Temp: 25 ° C | (1) ACD |
| Biokoncentrationsfaktor | 1230 | pH 7; Temp: 25 ° C | (1) ACD |
| Biokoncentrationsfaktor | 1190 | pH 8; Temp: 25 ° C | (1) ACD |
| Biokoncentrationsfaktor | 861 | pH 9; Temp: 25 ° C | (1) ACD |
| Biokoncentrationsfaktor | 238 | pH 10; Temp: 25 ° C | (1) ACD |
(1) Beräknad med hjälp av Advanced Chemistry Development (ACD/LABS) Software V11.02 (© 1994-2023 ACD/LABS)
Kemisk
| Egendom | Värde | Skick | Källa |
| Koc | 5690 | pH 1; Temp: 25 ° C | (1) ACD |
| Koc | 5690 | ph 2; Temp: 25 ° C | (1) ACD |
| Koc | 5690 | pH 3; Temp: 25 ° C | (1) ACD |
| Koc | 5690 | pH 4; Temp: 25 ° C | (1) ACD |
| Koc | 5690 | pH 5; Temp: 25 ° C | (1) ACD |
| Koc | 5690 | pH 6; Temp: 25 ° C | (1) ACD |
| Koc | 5670 | pH 7; Temp: 25 ° C | (1) ACD |
| Koc | 5450 | pH 8; Temp: 25 ° C | (1) ACD |
| Egendom | Värde | Skick | Källa |
| Koc | 3960 | pH 9; Temp: 25 ° C | (1) ACD |
| Koc | 1100 | pH 10; Temp: 25 ° C | (1) ACD |
| logd | 4.37 | pH 1; Temp: 25 ° C | (1) ACD |
| logd | 4.37 | ph 2; Temp: 25 ° C | (1) ACD |
| logd | 4.37 | pH 3; Temp: 25 ° C | (1) ACD |
| logd | 4.37 | pH 4; Temp: 25 ° C | (1) ACD |
| logd | 4.37 | pH 5; Temp: 25 ° C | (1) ACD |
| logd | 4.37 | pH 6; Temp: 25 ° C | (1) ACD |
| logd | 4.37 | pH 7; Temp: 25 ° C | (1) ACD |
| logd | 4.35 | pH 8; Temp: 25 ° C | (1) ACD |
| logd | 4.21 | pH 9; Temp: 25 ° C | (1) ACD |
| logd | 3.66 | pH 10; Temp: 25 ° C | (1) ACD |
| inloggning | 4.372 ± 0,582 | Temp: 25 ° C | (1) ACD |
| Massa inneboende löslighet | 3,7 x 10-4 g/l | Temp: 25 ° C | (1) ACD |
| Masslöslighet | 3,7 x 10-4 g/l | pH 1; Temp: 25 ° C | (1) ACD |
| Masslöslighet | 3,7 x 10-4 g/l | ph 2; Temp: 25 ° C | (1) ACD |
| Masslöslighet | 3,7 x 10-4 g/l | pH 3; Temp: 25 ° C | (1) ACD |
| Masslöslighet | 3,7 x 10-4 g/l | pH 4; Temp: 25 ° C | (1) ACD |
| Masslöslighet | 3,7 x 10-4 g/l | pH 5; Temp: 25 ° C | (1) ACD |
| Masslöslighet | 3,7 x 10-4 g/l | pH 6; Temp: 25 ° C | (1) ACD |
| Masslöslighet | 3,7 x 10-4 g/l | pH 7; Temp: 25 ° C | (1) ACD |
| Masslöslighet | 3,8 x 10-4 g/l | pH 8; Temp: 25 ° C | (1) ACD |
| Masslöslighet | 5,3 x 10-4 g/l | pH 9; Temp: 25 ° C | (1) ACD |
| Masslöslighet | 1,9 x 10-3 g/l | pH 10; Temp: 25 ° C | (1) ACD |
| Masslöslighet | 3,7 x 10-4 g/l | Obuffrat vatten pH 6,99; Temp: 25 ° C | (1) ACD |
| Molar inre löslighet | 6.6 x 10-7 mol/l | Temp: 25 ° C | (1) ACD |
| Mollöslighet | 6.6 x 10-7 mol/l | pH 1; Temp: 25 ° C | (1) ACD |
| Mollöslighet | 6.6 x 10-7 mol/l | ph 2; Temp: 25 ° C | (1) ACD |
| Mollöslighet | 6.6 x 10-7 mol/l | pH 3; Temp: 25 ° C | (1) ACD |
| Mollöslighet | 6.6 x 10-7 mol/l | pH 4; Temp: 25 ° C | (1) ACD |
| Mollöslighet | 6.6 x 10-7 mol/l | pH 5; Temp: 25 ° C | (1) ACD |
| Mollöslighet | 6.6 x 10-7 mol/l | pH 6; Temp: 25 ° C | (1) ACD |
| Egendom | Värde | Skick | Källa |
| Mollöslighet | 6.6 x 10-7 mol/l | pH 7; Temp: 25 ° C | (1) ACD |
| Mollöslighet | 6,8 x 10-7 mol/l | pH 8; Temp: 25 ° C | (1) ACD |
| Mollöslighet | 9,4 x 10-7 mol/l | pH 9; Temp: 25 ° C | (1) ACD |
| Mollöslighet | 3,4 x 10-6 mol/l | pH 10; Temp: 25 ° C | (1) ACD |
| Mollöslighet | 6.6 x 10-7 mol/l | Obuffrat vatten pH 6,99; Temp: 25 ° C | (1) ACD |
| Molekylvikt | 560.60 | ||
| pka | 9.39 ± 0,10 | Mest sura temp: 25 ° C | (1) ACD |
(1) Beräknad med hjälp av Advanced Chemistry Development (ACD/LABS) Software V11.02 (© 1994-2023 ACD/LABS)
Densitet
| Egendom | Värde | Skick | Källa |
| Densitet | 1,35 ± 0,1 g/cm3 | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
| Molvolym | 412,9 ± 5,0 cm3/mol | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
(1) Beräknad med hjälp av Advanced Chemistry Development (ACD/LABS) Software V11.02 (© 1994-2023 ACD/LABS)
Lipinski
| Egendom | Värde | Skick | Källa |
| Fritt roterbara bindningar | 11 | (1) ACD | |
| H acceptorer | 10 | (1) ACD | |
| H givare | 2 | (1) ACD | |
| H givare/acceptor summa | 12 | (1) ACD | |
| inloggning | 4.372 ± 0,582 | Temp: 25 ° C | (1) ACD |
| Molekylvikt | 560.60 |
(1) Beräknad med hjälp av Advanced Chemistry Development (ACD/LABS) Software V11.02 (© 1994-2023 ACD/LABS)
Strukturrelaterad
| Egendom | Värde | Skick | Källa |
| Polär yta | 116 A2 | (1) ACD | |
(1) Beräknad med hjälp av Advanced Chemistry Development (ACD/LABS) Software V11.02 (© 1994-2023 ACD/LABS)
Spektra tillgängligt
1H NMR
13C NMR
![C39H37N5O7-adenosin, N-bensoyl-5'-O-O- [Bis (4-metoxifenyl) fenylmetyl] -2'- O-metyl- (9CI, ACI)](https://cdn.globalso.com/nvchem/Substance-Detail-300x300.jpg)
![C48H54N7O8P-adenosin, N-bensoyl-5 '-o- [bis (4-metoxifenyl) fenylmetyl] -2'-O-metyl-, 3 '-[2-cyanoetyl N, N-Bis (1-metyletyl) fosfor amidit] (ACI) (ACI) (ACI) (ACI) (ACI) (ACI) (ACI) (ACI)](https://cdn.globalso.com/nvchem/C48H54N7O8P-300x300.png)
![C41H43N3O9 cytidin, N-bensoyl-5'-O-O-O-[Bis (4-metoxifenyl) fenylmetyl] -2'-O- (2-metoxietyl) -5-metyl- (9CI, ACI) H335, H319, H31515](https://cdn.globalso.com/nvchem/C41H43N3O9-Cytidine-300x300.jpg)
![C41H39NO6 1-pyrrolidinekarboxylsyra, 2-[[Bis (4-metoxifenyl) fenylm etoxi] metyl] -4-hydroxi-, 9H-fluoren-9-ylmetylester, (2S, 4R)-(9 CI, ACI)](https://cdn.globalso.com/nvchem/C41H39NO6-1-Pyrrolidinecarboxylic-acid-300x300.jpg)
![C41H41N5O8 adenosin, N-bensoyl-5′-O-O-[Bis (4-metoxifenyl) fenylmetyl] -2′- O- (2-metoxietyl)-(9ci, ACI)](https://cdn.globalso.com/nvchem/C41H41N5O8-Adenosine-300x300.jpg)
![C44H53FN7O8 Guanosine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -deoxy-2′ – fluoro-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N,N-bis(1-methyl ethyl)phosphoramidite] (ACI)](https://cdn.globalso.com/nvchem/C44H53FN7O8-300x300.png)