![C53h66n7o8psi cas no: 104992-55-4 adenosine, n -o- [4-metoxyphyl] - methylethyl) phosphoramidite] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C53h66n7o8psi cas no: 104992-55-4 adenosine, n -o- [4-metoxyphyl] - metlethyl) phosphoramidite] (ACI) Wêneyê Featured](https://cdn.globalso.com/nvchem/C53H66N7O8PSi.png)
C53h66n7o8psi cas no: 104992-55-4 adenosine, n -o- [4-metoxyphyl] - methylethyl) phosphoramidite] (ACI)
Hejmara Registry
104992-55-4
| Taybetmendiyên fîzîkî yên sereke | Giranî | Rewş |
| Giraniya molekul | 988.19 | - |
| PKA (texmîn kirin) | 7.87 ± 0.43 | Temana herî acid: 25 ° C |
Hespên Canonîkî
N # CCHOP (OC1C (OC (N2C = NC = 3C (= o) C = 4C (C) (c) (c) (c) c) cc5) (c6 = cc = c = c6) C7 = Cc = c (oc) c = c7) n (c (c) c) c (c) c
Isomeric bişirîn
C (OC [C @@ H] 1 [C @@ H] (Op (C (C) C) (C) (C) (C) (C) (C) (= o) = c4 = cc = c4 = c4) N = cn3) (c5 = cc = c (oc) c = c5) (c6 = cc = c (oc) c = c6) c7 = cc = cc = c7
Inchi
Inchi = 1s / c53h66n7o8psi / c1-36 (2) 60 (65-32-18-31-46-44 (33-64-53 (39-64-53 )-40-23-27-42 (62-8) 28-24-40 ) 41-26-41) 66-51 (46) 62-70 (10,6) 7) 59-35-57-45-48 (55-34-56-45-48 (55-34-56-45-48 (61) 38-19-14-12-15-19-38 / H1 2-17,19-30,34-47,44,46-47,44,46-37,44,4-11h3, (h, 55,56,58,61) / t44-, 46-, 47-, 51-, 69? / M1 / s1
Keyeya Inchi
Ffxhncnnhasxct-rfmfgjhusa-n
1 navê din ji bo vê madeyê
Adenosine,N-benzoyl-5 '-O- [BIS (4-Methoxyphenyl) Phenylmethyl] -2 '-O- [(1,1-Dimethylethyl) DimethylSilyL] -, 3 '- [2-Cyanoethyl bis (1- methylethyl) phosphoramidite] (9ci)
Spectra peyda dibe
Gel
Taybetmendiyên berdest
Bedirî
Şîmyakî
Lipinski
Struktura têkildar
| Mal | Giranî | Rewş | Kanî |
| Faktora BioconCentration | 5.50 x 105 | PH 1; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 2; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 3; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 4; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 5; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 6; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 7; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 8; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 9; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 10; Temp: 25 ° C | (1) ACD |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
| Mal | Giranî | Rewş | Kanî |
| Koc | 61500 | PH 1; Temp: 25 ° C | (1) ACD |
| Koc | 1.64 x 106 | PH 2; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | PH 3; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | PH 4; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | PH 5; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | PH 6; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | PH 7; Temp: 25 ° C | (1) ACD |
| Koc | 1.00 x 107 | PH 8; Temp: 25 ° C | (1) ACD |
| Koc | 3.20 x 106 | PH 9; Temp: 25 ° C | (1) ACD |
| Mal | Giranî | Rewş | Kanî |
| Koc | 9.24 x 105 | PH 10; Temp: 25 ° C | (1) ACD |
| logd | 8.81 | PH 1; Temp: 25 ° C | (1) ACD |
| logd | 10.24 | PH 2; Temp: 25 ° C | (1) ACD |
| logd | 11.24 | PH 3; Temp: 25 ° C | (1) ACD |
| logd | 11.73 | PH 4; Temp: 25 ° C | (1) ACD |
| logd | 11.83 | PH 5; Temp: 25 ° C | (1) ACD |
| logd | 11.83 | PH 6; Temp: 25 ° C | (1) ACD |
| logd | 11.75 | PH 7; Temp: 25 ° C | (1) ACD |
| logd | 11.31 | PH 8; Temp: 25 ° C | (1) ACD |
| logd | 10.53 | PH 9; Temp: 25 ° C | (1) ACD |
| logd | 9.99 | PH 10; Temp: 25 ° C | (1) ACD |
| logp | 11.845 ± 0.715 | Temp: 25 ° C | (1) ACD |
| Solubilityê dorpêçkirî ya girseyî | 1.2 x 10-5 G / L | Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 3.5 x 10-3 g / l | PH 1; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 1.1 x 10-4 g / l | PH 2; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 9.9 x 10-6 G / L | PH 3; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 3.4 x 10-6 g / l | PH 4; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 2.7 x 10-6 g / l | PH 5; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 2.7 x 10-6 g / l | PH 6; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 3.2 x 10-6 g / l | PH 7; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 8.9 x 10-6 G / L | PH 8; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 6.3 x 10-5 G / L | PH 9; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 4.2 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 3.2 x 10-6 g / l | Wateriyayê Unbuffered PH 7.00; Temp: 25 ° C | (1) ACD |
| Solubility ya hundurîn a molar | 1.2 x 10-8 mol / l | Temp: 25 ° C | (1) ACD |
| Solubility molar | 3.5 x 10-6 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
| Solubility molar | 1.1 x 10-7 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
| Solubility molar | 1.0 x 10-8 mol / l | PH 3; Temp: 25 ° C | (1) ACD |
| Solubility molar | 3.4 x 10-9 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
| Solubility molar | 2.7 x 10-9 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
| Solubility molar | 2.7 x 10-9 mol / l | PH 6; Temp: 25 ° C | (1) ACD |
| Solubility molar | 3.2 x 10-9 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
| Mal | Giranî | Rewş | Kanî |
| Solubility molar | 9.0 x 10-9 MOL / L | PH 8; Temp: 25 ° C | (1) ACD |
| Solubility molar | 6.4 x 10-8 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
| Solubility molar | 4.2 x 10-7 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
| Solubility molar | 3.2 x 10-9 mol / l | Wateriyayê Unbuffered PH 7.00; Temp: 25 ° C | (1) ACD |
| Giraniya molekul | 988.19 | ||
| pka | 7.87 ± 0.43 | Temana herî acid: 25 ° C | (1) ACD |
| pka | 3.45 ± 0.70 | Temana herî bingehîn: 25 ° C | (1) ACD |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
| Mal | Giranî | Rewş | Kanî |
| Bonds rotatable ya azad | 21 | (1) ACD | |
| H qebûlkar | 15 | (1) ACD | |
| H Donors | 1 | (1) ACD | |
| H Donor / Qedexe | 16 | (1) ACD | |
| logp | 11.845 ± 0.715 | Temp: 25 ° C | (1) ACD |
| Giraniya molekul | 988.19 |
| Mal | Giranî | Çavkaniya şertê |
| Qada pola polar | 178 A2 | (1) ACD |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
Pêşveçûna kîmya pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
Spectra peyda dibe
1 H NMR
13 C NMR
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