![Guanóisín C45H56N7O9P, 5′ -O- [bis(4-methocsaifeinil)feanilmheitil]-2′ -O-meitil- N-(2-meitil-1-ocsaeapróipil)-, 3′ – [2-cianeatáile N,N-bis (1-meitileitil) fosfaraimídít] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![Guanóisín C45H56N7O9P, 5′ -O- [bis(4-methocsaifeinil)feanilmheitil]-2′ -O-meitil- N-(2-meitil-1-ocsaeapróipil)-, 3′ – [2-cianeatáile N,N-bis (1-methylethyl) fosfaramidite] (ACI) Íomhá Réadmhaoin](https://cdn.globalso.com/nvchem/C45H56N7O9P.png)
Guanóisín C45H56N7O9P, 5′ -O- [bis(4-methocsaifeinil)feanilmheitil]-2′ -O-meitil- N-(2-meitil-1-ocsaeapróipil)-, 3′ – [2-cianeatáile N,N-bis (1-meitileitil) fosfaraimídít] (ACI)
Uimhir Chláraithe CAS
150780-67-9
H303
| Príomh-Airíonna Fisiceacha | Luach | Coinníoll |
| Meáchan Móilíneach | 869.94 | - |
| pKa (Tuartha) | 9.16±0.20 | Teocht is Airde: 25 °C |
N#CCCOP(OC1C(OC(N2C=NC=3C(=O)N=C(NC(=O)C(C)C)NC32)C1OC)COC(C=4C=CC=CC4)(C5=CC =C(OC)C=C5)C6=CC=C(OC)C=C6)N(C(C)C)C(C)C
SMILES Isiméireacha
C(OC[C@@H]1[C@H](OP(N(C)C)C(C)C)OCCC#N)[C@@H](OC)[C@@ H](O1)N2C3=C(N=C2)C(=O)N=C(NC(C(C)C)=O)N3)(C4=CC=C(OC) C=C4)(C5 =CC=C(OC)C=C5)C6=CC=CC=C6
InchI
InChI= 1S/C45H56N7O9P/c1-28(2)41(53)49-44-48-40-37(42(54)50-44)47-27-51(40)43-39(57-9) 38(61- 62(59-25- 13- 24-
46)52(29(3)4)30(5)6)36(60-43)26-58-45(31-14-11-10-12-15-31,32-16-20-34( 55-7)21-17-32)33-18-22-35(56-8)23-19-33/h10-12,14-23,27-30,36,38-39,43H,13, 25-26H2,1-9H3,(H2,48,49,50,53,54)/t36-,38-,39-,43-,62?/m1/s1
Eochair InChI
IRRDHRZUOZNWDJ-MLLDKZSOSA-N
1 Ainm Eile don tSubstaint seo
Guanáin, 5′ -O- [bis(4- meatocsaifeinil)feinilmeitil]-2′ -O-meitil-N-(2-meitil-1-ocsaeapróipil)-, 3′ - [2-cianoethyl bis(1-meitileitil) fosfaraimít] (9CI)
Spectra ar fáil
13 C NMR
Hetero NMR
Airíonna ar fáil
Bitheolaíoch
Ceimiceach
Lipinski
Struchtúr Gaolmhar
| Maoin | Luach | Coinníoll | Foinse |
| Fachtóir Bithtiúchana | 183 | pH 1; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 3890 | pH 2; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 35500 | pH 3; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 1.08×105 | pH 4; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 1.36×105 | pH 5; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 1.39×105 | pH 6; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 1.38×105 | pH 7; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 1.24×105 | pH 8; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 63600 | pH 9; Teocht: 25 °C | (1) ACD |
| Fachtóir Bithtiúchana | 11900 | pH 10; Teocht: 25 °C | (1) ACD |
(1) Ríomh ag baint úsáide as Bogearraí Ardfhorbartha Ceimice (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Maoin | Luach | Coinníoll | Foinse |
| Cóc | 220 | pH 1; Teocht: 25 °C | (1) ACD |
| Cóc | 4680 | pH 2; Teocht: 25 °C | (1) ACD |
| Cóc | 42600 | pH 3; Teocht: 25 °C | (1) ACD |
| Cóc | 1.30×105 | pH 4; Teocht: 25 °C | (1) ACD |
| Cóc | 1.63×105 | pH 5; Teocht: 25 °C | (1) ACD |
| Cóc | 1.67×105 | pH 6; Teocht: 25 °C | (1) ACD |
| Cóc | 1.65×105 | pH 7; Teocht: 25 °C | (1) ACD |
| Cóc | 1.49×105 | pH 8; Teocht: 25 °C | (1) ACD |
| Maoin | Luach | Coinníoll | Foinse |
| Cóc | 76400 | pH 9; Teocht: 25 °C | (1) ACD |
| Cóc | 14200 | pH 10; Teocht: 25 °C | (1) ACD |
| logD | 4. 19 | pH 1; Teocht: 25 °C | (1) ACD |
| logD | 5.52 | pH 2; Teocht: 25 °C | (1) ACD |
| logD | 6.48 | pH 3; Teocht: 25 °C | (1) ACD |
| logD | 6. 96 | pH 4; Teocht: 25 °C | (1) ACD |
| logD | 7. 06 | pH 5; Teocht: 25 °C | (1) ACD |
| logD | 7. 07 | pH 6; Teocht: 25 °C | (1) ACD |
| logD | 7. 07 | pH 7; Teocht: 25 °C | (1) ACD |
| logD | 7. 02 | pH 8; Teocht: 25 °C | (1) ACD |
| logD | 6.73 | pH 9; Teocht: 25 °C | (1) ACD |
| logD | 6.00 | pH 10; Teocht: 25 °C | (1) ACD |
| logP | 7.072±0.721 | Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Intreach Aifrinn | 1.2 x 10-4 g/L | Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 0.096 g/L | pH 1; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 4.3 x 10-3 g/L | pH 2; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 4.8 x 10-4 g/L | pH 3; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 1.6 x 10-4 g/L | pH 4; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 1.2 x 10-4 g/L | pH 5; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 1.2 x 10-4 g/L | pH 6; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 1.2 x 10-4 g/L | pH 7; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 1.4 x 10-4 g/L | pH 8; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 2.7 x 10-4 g/L | pH 9; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 1.4 x 10-3 g/L | pH 10; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Aifreann | 1.2 x 10-4 g/L | Uisce Neamh-mhaolaithe pH 7.00; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Intreach Molar | 1.4 x 10-7 mol/L | Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 1.1 x 10-4 mol/L | pH 1; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 5.0 x 10-6 mol/L | pH 2; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 5.5 x 10-7 mol/L | pH 3; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 1.8 x 10-7 mol/L | pH 4; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 1.4 x 10-7 mol/L | pH 5; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 1.4 x 10-7 mol/L | pH 6; Teocht: 25 °C | (1) ACD |
| Maoin | Luach | Coinníoll | Foinse |
| Tuaslagthacht Molar | 1.4 x 10-7 mol/L | pH 7; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 1.6 x 10-7 mol/L | pH 8; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 3.1 x 10-7 mol/L | pH 9; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 1.6 x 10-6 mol/L | pH 10; Teocht: 25 °C | (1) ACD |
| Tuaslagthacht Molar | 1.4 x 10-7 mol/L | Uisce Neamh-mhaolaithe pH 7.00; Teocht: 25 °C | (1) ACD |
| Meáchan Móilíneach | 869.94 | ||
| pKa | 9.16±0.20 | Teocht is Airde: 25 °C | (1) ACD |
| pKa | 3.45±0.70 | Teocht is Bunúsaí: 25 °C | (1) ACD |
(1) Ríomh ag baint úsáide as Bogearraí Ardfhorbartha Ceimice (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Maoin | Luach | Coinníoll | Foinse |
| Bannaí Rothlach Saor in Aisce | 19 | (1) ACD | |
| H Glacadóirí | 16 | (1) ACD | |
| H Deontóirí | 2 | (1) ACD | |
| H Suim Deontóra/Ghlacadóir | 18 | (1) ACD | |
| logP | 7.072±0.721 | Teocht: 25 °C | (1) ACD |
| Meáchan Móilíneach | 869.94 |
(1) Ríomh ag baint úsáide as Bogearraí Ardfhorbartha Ceimice (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Maoin | Luach | Foinse Coinníoll |
| Achar Dromchla Polar | 194 A2 | (1) ACD |
(1) Ríomh ag baint úsáide as Bogearraí Ardfhorbartha Ceimice (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Spectra ar fáil
1 H NMR
13 C NMR
| Cód | Ráiteas Guaise | Foinse |
| H303 | D'fhéadfadh sé a bheith díobhálach má shlogtar é | Saineolaí Coimeádta |
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