![C43H55N4O10P Uridine, 5'-O- [bis(4-methoxyphenyl)phenylmethyl]-2'-O-(2-methox yethyl)- 5-methyl-, 3'- [2-cyanoethyl N,N-bis(1-) methylethyl)fosforamidite] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C43H55N4O10P Uridine, 5'-O- [bis(4-methoxyphenyl)phenylmethyl]-2'-O-(2-methox yethyl)- 5-methyl-, 3'- [2-cyanoethyl N,N-bis(1-) methylethyl) fosfor amidite] (ACI) Featured Image](https://cdn.globalso.com/nvchem/C43H55N4O10P-Uridine.png)
C43H55N4O10P Uridine, 5'-O- [bis(4-methoxyphenyl)phenylmethyl]-2'-O-(2-methox yethyl)- 5-methyl-, 3'- [2-cyanoethyl N,N-bis(1-) methylethyl)fosforamidite] (ACI)
CAS Registry Number
163878-63-5
H302
| Key Physical Properties | Wearde | Betingst |
| Molekulêr gewicht | 818.89 | - |
| pKa (foarsein) | 9,55±0,10 | Meast soere Temp: 25 °C |
Canonical SMILES
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)C
Isomere SMILES
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
InChI
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)2 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 Key
YFRRKZDUDXHJNC-KZQAAKLLSA-N
17 Oare nammen foar dizze stof
Uridine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-(2-methoxyethyl)-5-methyl-, 3'- [2-cyanoethylbis(1-methylethyl)fosfor
amidyt] (9CI); 10: PN: US20030212017 PAGE: 18 opeaske RNA; 11: PN: US20030211606 PAGE: 18 opeaske RNA; 13: PN: US20040
005569 PAGE: 21 opeaske RNA; 13: PN: US20040006030 PAGE: 22 opeaske RNA; 13: PN: US20040014048 PAGE: 19 opeaske RNA; 13: PN: US20040014049 PAGE: 19 opeaske RNA; 14: PN: US20030198965 PAGE: 19 opeaske RNA; 14: PN: US20040005565 PAGE: 17- 22 opeaske RNA; 14: PN: US20040005570 PAGE: 19 opeaske RNA; 14: PN: US20040014047 PAGE: 19 opeaske RNA; 14: PN: US20040
014699 PAGE: 19 opeaske RNA; 15: PN: US20040014050 PAGE: 19 opeaske RNA; 15: PN: US20040014051 PAGE: 21 opeaske RNA; 15:
PN: WO03106645 PAGE: 69 opeaske RNA; 16: PN: US20040006029 PAGE: 22 opeaske RNA; 87: PN: US20040005707 PAGE: 19 opeaske RNA
Spectra beskikber
1H NMR
13C NMR
Hetero NMR
Eigenskippen beskikber
Biologysk
Gemysk
Lipinski
Struktuer Related
| Besit | Wearde | Betingst | Boarne |
| Biokonsintraasjefaktor | 348 | pH 1; Temp: 25 °C | (1) ACD |
| Biokonsintraasjefaktor | 2810 | pH 2; Temp: 25 °C | (1) ACD |
| Biokonsintraasjefaktor | 21100 | pH 3; Temp: 25 °C | (1) ACD |
| Biokonsintraasjefaktor | 63100 | pH 4; Temp: 25 °C | (1) ACD |
| Biokonsintraasjefaktor | 78800 | pH 5; Temp: 25 °C | (1) ACD |
| Biokonsintraasjefaktor | 80800 | pH 6; Temp: 25 °C | (1) ACD |
| Biokonsintraasjefaktor | 80800 | pH 7; Temp: 25 °C | (1) ACD |
| Biokonsintraasjefaktor | 78800 | pH 8; Temp: 25 °C | (1) ACD |
| Biokonsintraasjefaktor | 63400 | pH 9; Temp: 25 °C | (1) ACD |
| Biokonsintraasjefaktor | 21800 | pH 10; Temp: 25 °C | (1) ACD |
(1) Berekkene mei Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Besit | Wearde | Betingst | Boarne |
| 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 |
| Besit | Wearde | Betingst | Boarne |
| 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 |
| Mass Intrinsic Solubility | 2,0 x 10-4 g/L | Temp: 25 °C | (1) ACD |
| Massasolubiliteit | 0,046 g/L | pH 1; Temp: 25 °C | (1) ACD |
| Massasolubiliteit | 5,7 x 10-3 g/L | pH 2; Temp: 25 °C | (1) ACD |
| Massasolubiliteit | 7,6 x 10-4 g/L | pH 3; Temp: 25 °C | (1) ACD |
| Massasolubiliteit | 2,5 x 10-4 g/L | pH 4; Temp: 25 °C | (1) ACD |
| Massasolubiliteit | 2,0 x 10-4 g/L | pH 5; Temp: 25 °C | (1) ACD |
| Massasolubiliteit | 2,0 x 10-4 g/L | pH 6; Temp: 25 °C | (1) ACD |
| Massasolubiliteit | 2,0 x 10-4 g/L | pH 7; Temp: 25 °C | (1) ACD |
| Massasolubiliteit | 2,0 x 10-4 g/L | pH 8; Temp: 25 °C | (1) ACD |
| Massasolubiliteit | 2,5 x 10-4 g/L | pH 9; Temp: 25 °C | (1) ACD |
| Massasolubiliteit | 7,4 x 10-4 g/L | pH 10; Temp: 25 °C | (1) ACD |
| Massasolubiliteit | 2,0 x 10-4 g/L | Unbuffered wetter pH 7,00; Temp: 25 °C | (1) ACD |
| Molêre yntrinsike oplosberens | 2,4 x 10-7 mol/L | Temp: 25 °C | (1) ACD |
| Molêre oplosberens | 5,6 x 10-5 mol/L | pH 1; Temp: 25 °C | (1) ACD |
| Molêre oplosberens | 7,0 x 10-6 mol/L | pH 2; Temp: 25 °C | (1) ACD |
| Besit | Wearde | Betingst | Boarne |
| Molêre oplosberens | 9,3 x 10-7 mol/L | pH 3; Temp: 25 °C | (1) ACD |
| Molêre oplosberens | 3,1 x 10-7 mol/L | pH 4; Temp: 25 °C | (1) ACD |
| Molêre oplosberens | 2,5 x 10-7 mol/L | pH 5; Temp: 25 °C | (1) ACD |
| Molêre oplosberens | 2,4 x 10-7 mol/L | pH 6; Temp: 25 °C | (1) ACD |
| Molêre oplosberens | 2,4 x 10-7 mol/L | pH 7; Temp: 25 °C | (1) ACD |
| Molêre oplosberens | 2,5 x 10-7 mol/L | pH 8; Temp: 25 °C | (1) ACD |
| Molêre oplosberens | 3,1 x 10-7 mol/L | pH 9; Temp: 25 °C | (1) ACD |
| Molêre oplosberens | 9,0 x 10-7 mol/L | pH 10; Temp: 25 °C | (1) ACD |
| Molêre oplosberens | 2,4 x 10-7 mol/L | Unbuffered wetter pH 7,00; Temp: 25 °C | (1) ACD |
| Molekulêr gewicht | 818.89 | ||
| pKa | 9,55±0,10 | Meast soere Temp: 25 °C | (1) ACD |
| pKa | 3,45±0,70 | Meast Basic Temp: 25 °C | (1) ACD |
(1) Berekkene mei Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Besit | Wearde | Betingst | Boarne |
| Frij draaibare obligaasjes | 21 | (1) ACD | |
| H Aksepteurs | 14 | (1) ACD | |
| H Donateurs | 1 | (1) ACD | |
| H Donor / Akseptor Sum | 15 | (1) ACD | |
| logP | 6.761±0.669 | Temp: 25 °C | (1) ACD |
| Molekulêr gewicht | 818.89 |
(1) Berekkene mei Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Besit | Wearde | Betingst Boarne |
| Polar Surface Area | 164 A2 | (1) ACD |
(1) Berekkene mei Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra beskikber
1H NMR
13C NMR
| Code Hazard Statement Boarne | |
| H302 Skealik by ynslikken | European Chemical Agency (ECHA) Klassifikaasje en Labeling Ynventarisaasje - Notifisearre klassifikaasje en etikettering - meast foarkommende notifikaasjes, European Chemical Agency (ECHA) Ynventarisaasje fan klassifikaasje en etikettering - Notifisearre klassifikaasje en etikettering - meast serieuze notifikaasjes |
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