![C50H58N7O9P Adenosine, N-beinsóil-5′-O-[bis(4-meatocsafeinil)feinilmeitil]-2′ – O-(2-meatocsaeitile)-, 3′ – [2-cianóeitile N,N-bis(1-meitileitile) fosfaramidít] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C50H58N7O9P Adenosine, N-beinsóil-5′-O-[bis(4-meatocsaifeinil)feinilmeitil]-2′ – O-(2-meatocsaieitile)-, 3′ – [2-cianóeitile N,N-bis(1-meitileitile) fosfaramidít] (ACI) Íomhá Réadmhaoin](https://www.csnvchem.com/uploads/C50H58N7O9P-Adenosine.png)
C50H58N7O9P Adenosine, N-beinsóil-5′-O-[bis(4-meatocsafeinil)feinilmeitil]-2′ – O-(2-meatocsaeitile)-, 3′ – [2-cianóeitile N,N-bis(1-meitileitile) fosfaramidít] (ACI)
Uimhir Chlárúcháin CAS
251647-53-7
H302
| Príomhairíonna Fisiceacha | Luach | Coinníoll |
| Meáchan Móilíneach | 932.01 | - |
| pKa (Tuartha) | 7.87±0.43 | Teocht is Aigéadaí: 25 °C |
GÁIRÍ CHANÓNACHA
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(C7)N(C)
Gáirí Isiméireacha
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
Eochair InChI
VPBYBQBHLYRLHG-HDMAWCRFSA-N
16 Ainm Eile don tSubstaint seo
Adenosine,N-beinsóil-5′ -O- [bis(4-meatocsaifeinil)feinilmeitil]-2′ -O-(2-meatocsaeitile)-, 3′-[2-cianaeitile bis(1-meitileitile)
fosfaramidít] (9CI); 16: PN: US20030211606 LEATHANACH: 19 seicheamh éilithe; 16: PN: US20030212017 LEATHANACH: 20 seicheamh éilithe; 17: PN: US20040005569 LEATHANACH: 22 seicheamh éilithe; 19: PN: US20040006030 LEATHANACH: 23 seicheamh éilithe; 19: PN: US20040014047
LEATHANACH: 21 seicheamh éilithe; 19: PN: US20040014049 LEATHANACH: 21 seicheamh éilithe; 20: PN: US20040005570 LEATHANACH: 20 éilithe
seicheamh; 20: PN: US20040014048 LEATHANACH: 21 seicheamh éilithe; 20: PN: US20040014050 LEATHANACH: 20 seicheamh éilithe; 21: PN: U
S20040005565 LEATHANACH: 17-22 seicheamh éilithe; 21: PN: US20040014051 LEATHANACH: 23 seicheamh éilithe; 22: PN: US20040014699 LEATHANACH: 20 seicheamh éilithe; 23: PN: US20040006029 LEATHANACH: 23 seicheamh éilithe; 23: PN: WO03106645 LEATHANACH: 73 seicheamh éilithe; 94: P N: US20040005707 LEATHANACH: 20 seicheamh éilithe
Speictrim atá ar fáil
1H NMR
13C NMR
NMR heitreató
Maoine atá ar fáil
Bitheolaíoch
Ceimiceach
Lipinski
Struchtúr Gaolmhar
| Maoin | Luach | Coinníoll | Foinse |
| Fachtóir Bith-thiúchana | 2680 | pH 1; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 71500 | pH 2; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 7.21 x 105 | pH 3; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 1.00 x 106 | pH 4; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 1.00 x 106 | pH 5; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 1.00 x 106 | pH 6; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 1.00 x 106 | pH 7; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 8.48 x 105 | pH 8; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 1.39 x 105 | pH 9; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 40300 | pH 10; Teocht: 25 °C | (1) ACD |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Maoin | Luach | Coinníoll | Foinse |
| Koc | 1360 | pH 1; Teocht: 25 °C | (1) ACD |
| Koc | 36300 | pH 2; Teocht: 25 °C | (1) ACD |
| Koc | 3.66 x 105 | pH 3; Teocht: 25 °C | (1) ACD |
| Koc | 1.13 x 106 | pH 4; Teocht: 25 °C | (1) ACD |
| Maoin | Luach | Coinníoll | Foinse |
| Koc | 1.42 x 106 | pH 5; Teocht: 25 °C | (1) ACD |
| Koc | 1.42 x 106 | pH 6; Teocht: 25 °C | (1) ACD |
| Koc | 1.17 x 106 | pH 7; Teocht: 25 °C | (1) ACD |
| Koc | 4.30 x 105 | pH 8; Teocht: 25 °C | (1) ACD |
| Koc | 70800 | pH 9; Teocht: 25 °C | (1) ACD |
| Koc | 20500 | pH 10; Teocht: 25 °C | (1) ACD |
| logD | 5.77 | pH 1; Teocht: 25 °C | (1) ACD |
| logD | 7.20 | pH 2; Teocht: 25 °C | (1) ACD |
| logD | 8.20 | pH 3; Teocht: 25 °C | (1) ACD |
| logD | 8.69 | pH 4; Teocht: 25 °C | (1) ACD |
| logD | 8.79 | pH 5; Teocht: 25 °C | (1) ACD |
| logD | 8.79 | pH 6; Teocht: 25 °C | (1) ACD |
| logD | 8.71 | pH 7; Teocht: 25 °C | (1) ACD |
| logD | 8.27 | pH 8; Teocht: 25 °C | (1) ACD |
| logD | 7.49 | pH 9; Teocht: 25 °C | (1) ACD |
| logD | 6.95 | pH 10; Teocht: 25 °C | (1) ACD |
| logP | 8.803±0.766 | Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Intreach Mais | 5.4 x 10-5 g/L | Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 0.051 g/L | pH 1; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.9 x 10-3 g/L | pH 2; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.9 x 10-4 g/L | pH 3; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 6.0 x 10-5 g/L | pH 4; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 4.8 x 10-5 g/L | pH 5; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 4.8 x 10-5 g/L | pH 6; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 5.8 x 10-5 g/L | pH 7; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.6 x 10-4 g/L | pH 8; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 9.3 x 10-4 g/L | pH 9; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 3.6 x 10-3 g/L | pH 10; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 5.7 x 10-5 g/L | Uisce Gan Maolán pH 6.97; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Intreach Mhólar | 5.8 x 10-8 móil/L | Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 5.5 x 10-5 móil/L | pH 1; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 2.0 x 10-6 móil/L | pH 2; Teocht: 25 °C | (1) ACD |
| Maoin | Luach | Coinníoll | Foinse |
| Intuaslagthacht Mhólar | 2.0 x 10-7 móil/L | pH 3; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 6.4 x 10-8 móil/L | pH 4; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 5.1 x 10-8 móil/L | pH 5; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 5.1 x 10-8 móil/L | pH 6; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 6.2 x 10-8 móil/L | pH 7; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 1.7 x 10-7 móil/L | pH 8; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 1.0 x 10-6 móil/L | pH 9; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 3.9 x 10-6 móil/L | pH 10; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 6.1 x 10-8 móil/L | Uisce Gan Maolán pH 6.97; Teocht: 25 °C | (1) ACD |
| Meáchan Móilíneach | 932.01 | ||
| pKa | 7.87±0.43 | Teocht is Aigéadaí: 25 °C | (1) ACD |
| pKa | 3.45±0.70 | Teocht is Bunúsaí: 25 °C | (1) ACD |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Maoin | Luach | Coinníoll | Foinse |
| Bannaí Rothlach Saor in Aisce | 22 | (1) ACD | |
| Glacadóirí H | 16 | (1) ACD | |
| Deontóirí H | 1 | (1) ACD | |
| Suim an Deontóra/Glacadóra H | 17 | (1) ACD | |
| logP | 8.803±0.766 | Teocht: 25 °C | (1) ACD |
| Meáchan Móilíneach | 932.01 |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Maoin | Luach | Foinse Coinníoll |
| Achar Dromchla Polach | 187 A2 | (1) ACD |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Speictrim atá ar fáil
1H NMR
13C NMR
| Foinse Ráiteas Guaise Cód | |
| H302 Díobhálach má shlogtar é | Aicmiú agus Lipéadú na Gníomhaireachta Eorpaí Ceimiceán (ECHA) Fardal - Aicmiú agus lipéadú fógartha - na fógraí is coitianta, Gníomhaireacht Eorpach Ceimiceán (ECHA) Fardal Aicmithe agus Lipéadaithe - Aicmiú agus lipéadú fógartha - na fógraí is tromchúisí |
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