![C43H55N4O10P Uridine, 5 ′ -o- [bis (4-methoxyphenyl) fenielmethyl] -2 ′ -o- (2-methox yethyl)-5-metiel-, 3 ′-[2-cyanoethyl N, N-Bis (1-metieletiel) fosfor amidiet] (ACI) (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C43H55N4O10P uridien, 5 ′ -o- [bis (4-methoxyphenyl) fenielmetiel] -2 ′ -o- (2-methox yethyl)-5-metiel-, 3 ′-[2-cyanohyl N, N-Bis (1-metieletiel) fosfor amidiet] (ACI) het beeld vertoon](https://cdn.globalso.com/nvchem/C43H55N4O10P-Uridine.png)
C43H55N4O10P Uridine, 5 ′ -o- [bis (4-methoxyphenyl) fenielmethyl] -2 ′ -o- (2-methox yethyl)-5-metiel-, 3 ′-[2-cyanoethyl N, N-Bis (1-metieletiel) fosfor amidiet] (ACI) (ACI)
CAS -registernommer
163878-63-5
H302
| Belangrike fisiese eienskappe | Waarde | Toestand |
| Molekulêre gewig | 818.89 | - |
| PKA (voorspel) | 9,55 ± 0,10 | Die meeste suur temp: 25 ° C |
Kanonieke glimlagte
N#CCCOP (OC1C (OC (N2C = C (C (= O) NC2 = O) C) C1OCCOC) COC (C = 3C = CC = CC3) (C4 = CC = C (OC) C = C4) C5 = CC = C (OC) C = C5) N (C) C) C (C) C)
Isomeriese glimlagte
C (oc [c @@ h] 1 [c @@ h] (op (n (c (c) c) c (c) c) occc#n) [c @@ h] (occoc) [c @@ h] (o1) n2c (= o) nc (= o) c (c) = c2) (c3 = cc = c (oc) c = c3) (c4 = cc = C (oc) c = c4) c5 = cc = cc = c5
Duim
INCHI = 1S/C43H55N4O10P/C1-29 (2) 47 (30 (3) 4) 58 (55-24-12-23-44) 57-38-37 (56-41 (39 (38) 53-26-25-50-6) 46-27-31 (5) 40 (48) 45-42 (46) 49) 8-54-43 (32-13-10-9-11-14-32,33-15-19-35 (51-7) 20-16-33) 34-17-21-36 (52-8) 22-18-34/H9-11,13-22,27,29-30,37-39,41H, 12,24-26,28H2, 1-8H3, (H, 45,48,49)/T37-, 38-, 39-, 41-, 58?/M1/S1
Inchi -sleutel
YFRRKZDUDXHJNC-KZQAAKLLSA-N
17 ander name vir hierdie stof
Uridien, 5 ′ -O-[bis (4-metoksifeniel) fenielmetiel] -2 ′-O-(2-methoxyethyl)-5-metiel-, 3 ′-[2-cyanoethyl bis (1-metieletiel) fosfor
amidite] (9ci); 10: PN: US20030212017 Bladsy: 18 Eise RNA; 11: PN: US20030211606 Bladsy: 18 RNA geëis; 13: PN: US20040
005569 Bladsy: 21 RNA geëis; 13: PN: US20040006030 Page: 22 RNA geëis; 13: PN: US20040014048 Bladsy: 19 RNA geëis; 13: PN: US20040014049 Bladsy: 19 RNA geëis; 14: PN: US20030198965 Bladsy: 19 RNA geëis; 14: PN: US20040005565 Bladsy: 17- 22 RNA geëis; 14: PN: US20040005570 Bladsy: 19 RNA geëis; 14: PN: US20040014047 Bladsy: 19 RNA geëis; 14: PN: US20040
014699 Bladsy: 19 RNA geëis; 15: PN: US20040014050 Bladsy: 19 RNA geëis; 15: PN: US20040014051 Bladsy: 21 RNA geëis; 15:
PN: WO03106645 Bladsy: 69 RNA geëis; 16: PN: US20040006029 Bladsy: 22 RNA geëis; 87: PN: US20040005707 Bladsy: 19 Eise RNA
Spektra beskikbaar
1 H NMR
13 C NMR
Hetero NMR
Eiendom beskikbaar
Biologies
Chemies
Lipinski
Struktuurverwant
| Eiendom | Waarde | Toestand | Bron |
| Biokonsentrasiefaktor | 348 | Ph 1; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 2810 | Ph 2; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 21100 | Ph 3; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 63100 | Ph 4; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 78800 | Ph 5; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 80800 | Ph 6; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 80800 | Ph 7; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 78800 | Ph 8; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 63400 | Ph 9; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 21800 | Ph 10; Temp: 25 ° C | (1) ACD |
(1) Bereken met behulp van gevorderde chemie-ontwikkeling (ACD/labs) sagteware v11.02 (© 1994-2023 ACD/LABS)
| Eiendom | Waarde | Toestand | Bron |
| KOC | 487 | Ph 1; Temp: 25 ° C | (1) ACD |
| KOC | 3940 | Ph 2; Temp: 25 ° C | (1) ACD |
| KOC | 29600 | Ph 3; Temp: 25 ° C | (1) ACD |
| KOC | 88400 | Ph 4; Temp: 25 ° C | (1) ACD |
| Eiendom | Waarde | Toestand | Bron |
| KOC | 1.10 x 105 | Ph 5; Temp: 25 ° C | (1) ACD |
| KOC | 1.13 x 105 | Ph 6; Temp: 25 ° C | (1) ACD |
| KOC | 1.13 x 105 | Ph 7; Temp: 25 ° C | (1) ACD |
| KOC | 1.10 x 105 | Ph 8; Temp: 25 ° C | (1) ACD |
| KOC | 88800 | Ph 9; Temp: 25 ° C | (1) ACD |
| KOC | 30600 | Ph 10; Temp: 25 ° C | (1) ACD |
| logd | 4.39 | Ph 1; Temp: 25 ° C | (1) ACD |
| logd | 5.30 | Ph 2; Temp: 25 ° C | (1) ACD |
| logd | 6.18 | Ph 3; Temp: 25 ° C | (1) ACD |
| logd | 6.65 | Ph 4; Temp: 25 ° C | (1) ACD |
| logd | 6.75 | Ph 5; Temp: 25 ° C | (1) ACD |
| logd | 6.76 | Ph 6; Temp: 25 ° C | (1) ACD |
| logd | 6.76 | Ph 7; Temp: 25 ° C | (1) ACD |
| logd | 6.75 | Ph 8; Temp: 25 ° C | (1) ACD |
| logd | 6.65 | Ph 9; Temp: 25 ° C | (1) ACD |
| logd | 6.19 | Ph 10; Temp: 25 ° C | (1) ACD |
| logp | 6.761 ± 0.669 | Temp: 25 ° C | (1) ACD |
| Massa intrinsieke oplosbaarheid | 2,0 x 10-4 g/l | Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 0,046 g/l | Ph 1; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 5,7 x 10-3 g/l | Ph 2; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 7,6 x 10-4 g/l | Ph 3; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 2,5 x 10-4 g/l | Ph 4; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 2,0 x 10-4 g/l | Ph 5; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 2,0 x 10-4 g/l | Ph 6; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 2,0 x 10-4 g/l | Ph 7; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 2,0 x 10-4 g/l | Ph 8; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 2,5 x 10-4 g/l | Ph 9; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 7.4 x 10-4 g/l | Ph 10; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 2,0 x 10-4 g/l | Ongebufferde water pH 7,00; Temp: 25 ° C | (1) ACD |
| Molêre intrinsieke oplosbaarheid | 2,4 x 10-7 mol/l | Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 5,6 x 10-5 mol/l | Ph 1; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 7,0 x 10-6 mol/l | Ph 2; Temp: 25 ° C | (1) ACD |
| Eiendom | Waarde | Toestand | Bron |
| Molêre oplosbaarheid | 9.3 x 10-7 mol/l | Ph 3; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 3.1 x 10-7 mol/l | Ph 4; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 2,5 x 10-7 mol/l | Ph 5; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 2,4 x 10-7 mol/l | Ph 6; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 2,4 x 10-7 mol/l | Ph 7; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 2,5 x 10-7 mol/l | Ph 8; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 3.1 x 10-7 mol/l | Ph 9; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 9,0 x 10-7 mol/l | Ph 10; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 2,4 x 10-7 mol/l | Ongebufferde water pH 7,00; Temp: 25 ° C | (1) ACD |
| Molekulêre gewig | 818.89 | ||
| pka | 9,55 ± 0,10 | Die meeste suur temp: 25 ° C | (1) ACD |
| pka | 3,45 ± 0,70 | Die meeste basiese temp: 25 ° C | (1) ACD |
(1) Bereken met behulp van gevorderde chemie-ontwikkeling (ACD/labs) sagteware v11.02 (© 1994-2023 ACD/LABS)
| Eiendom | Waarde | Toestand | Bron |
| Vrylik draaibare bindings | 21 | (1) ACD | |
| H Acceptors | 14 | (1) ACD | |
| H -donateurs | 1 | (1) ACD | |
| H Skenker/Acceptor Sum | 15 | (1) ACD | |
| logp | 6.761 ± 0.669 | Temp: 25 ° C | (1) ACD |
| Molekulêre gewig | 818.89 |
(1) Bereken met behulp van gevorderde chemie-ontwikkeling (ACD/labs) sagteware v11.02 (© 1994-2023 ACD/LABS)
| Eiendom | Waarde | Toestandbron |
| Pooloppervlakte | 164 A2 | (1) ACD |
(1) Bereken met behulp van gevorderde chemie-ontwikkeling (ACD/labs) sagteware v11.02 (© 1994-2023 ACD/LABS)
Spektra beskikbaar
1 H NMR
13 C NMR
| Kode -gevaarverklaring bron | |
| H302 skadelik as dit ingesluk word | European Chemical Agency (ECHA) klassifikasie en etikettering Inventaris - In kennis gestel van klassifikasie en etikettering - die algemeenste kennisgewings, Europese chemiese agentskap (ECHA) Klassifikasie en etiketteringsvoorraad - In kennis gestel in klassifikasie en etikettering - die ernstigste kennisgewings |
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