C13H19N5O5 Adenosine, 2′ -O-(2-methoxyethyl)- (9CI, ACI)
Nambala ya Registry ya CAS
168427-74-5
| Zofunika Zathupi | Mtengo | Mkhalidwe |
| Kulemera kwa Maselo | 325.32 | - |
| Boiling Point (Zonenedweratu) | 639.0±65.0 °C | Press: 760 Torr |
| Kachulukidwe (Zonenedweratu) | 1.70±0.1 g/cm3 | Kutentha: 20 ° C; Press: 760 Torr |
| pKa (Zonenedweratu) | 13.12±0.70 | Kutentha Kwambiri kwa Acid: 25 ° C |
Canonical SMILES
OCC1OC(N2C= NC=3C(= NC= NC32)N)C(OCCOC)C1O
Isomeric AMAmwetulira
O(CCOC)[C@H]1[C@@H](O[C@H](CO)[C@H]1O)N2C=3C(N=C2)=C(N)N=CN3
InChi
InChI= 1S/C13H19N5O5/c1-21-2-3-22-10-9(20)7(4-19)23-13(10)18-6-17-8-11(14)15-5- 16-12(8)18/h5-7,9-10,13,19-20H,2-4H2,1H3, (H2,14,15,16)/t7-,9-,10-,13-/ m1/s1
InChi Key
PUDXUJRJLRLJIU-QYVSTXNMSA-N
1 Dzina Lina la chinthu ichi
2'-O-(2-Methoxyethyl)adenosine (ACI)
Spectra ilipo
1H NMR
13 C NMR
Katundu zilipo
Zachilengedwe
Chemical
Kuchulukana
Lipinski
Zogwirizana ndi Kapangidwe
Kutentha
| Katundu | Mtengo | Mkhalidwe | Gwero |
| Bioconcentration Factor | 1.0 | pH 1; Kutentha: 25 ° C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 2; Kutentha: 25 ° C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 3; Kutentha: 25 ° C | (1) ACD |
| Bioconcentration Factor | 1.0 | pH 4; Kutentha: 25 ° C | (1) ACD |
| Bioconcentration Factor | 1.18 | pH 5; Kutentha: 25 ° C | (1) ACD |
| Bioconcentration Factor | 1.31 | pH 6; Kutentha: 25 ° C | (1) ACD |
| Bioconcentration Factor | 1.32 | pH 7; Kutentha: 25 ° C | (1) ACD |
| Bioconcentration Factor | 1.32 | pH 8; Kutentha: 25 ° C | (1) ACD |
| Bioconcentration Factor | 1.32 | pH 9; Kutentha: 25 ° C | (1) ACD |
| Bioconcentration Factor | 1.32 | pH 10; Kutentha: 25 ° C | (1) ACD |
(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Katundu | Mtengo | Mkhalidwe | Gwero |
| Koc | 1.0 | pH 1; Kutentha: 25 ° C | (1) ACD |
| Koc | 1.0 | pH 2; Kutentha: 25 ° C | (1) ACD |
| Koc | 3.39 | pH 3; Kutentha: 25 ° C | (1) ACD |
| Koc | 19.4 | pH 4; Kutentha: 25 ° C | (1) ACD |
| Koc | 38.0 | pH 5; Kutentha: 25 ° C | (1) ACD |
| Koc | 42.0 | pH 6; Kutentha: 25 ° C | (1) ACD |
| Koc | 42.5 | pH 7; Kutentha: 25 ° C | (1) ACD |
| Katundu | Mtengo | Mkhalidwe | Gwero |
| Koc | 42.5 | pH 8; Kutentha: 25 ° C | (1) ACD |
| Koc | 42.5 | pH 9; Kutentha: 25 ° C | (1) ACD |
| Koc | 42.5 | pH 10; Kutentha: 25 ° C | (1) ACD |
| logD | -1.94 | pH 1; Kutentha: 25 ° C | (1) ACD |
| logD | -1.48 | pH 2; Kutentha: 25 ° C | (1) ACD |
| logD | -0.64 | pH 3; Kutentha: 25 ° C | (1) ACD |
| logD | 0.12 | pH 4; Kutentha: 25 ° C | (1) ACD |
| logD | 0.41 | pH 5; Kutentha: 25 ° C | (1) ACD |
| logD | 0.46 | pH 6; Kutentha: 25 ° C | (1) ACD |
| logD | 0.46 | pH 7; Kutentha: 25 ° C | (1) ACD |
| logD | 0.46 | pH 8; Kutentha: 25 ° C | (1) ACD |
| logD | 0.46 | pH 9; Kutentha: 25 ° C | (1) ACD |
| logD | 0.46 | pH 10; Kutentha: 25 ° C | (1) ACD |
| logP | 0.462±0.647 | Kutentha: 25 ° C | (1) ACD |
| Mass Intrinsic Solubility | 4.2g/L | Kutentha: 25 ° C | (1) ACD |
| Misa Solubility | 999g/l | pH 1; Kutentha: 25 ° C | (1) ACD |
| Misa Solubility | 381g/l | pH 2; Kutentha: 25 ° C | (1) ACD |
| Misa Solubility | 55g/l | pH 3; Kutentha: 25 ° C | (1) ACD |
| Misa Solubility | 9.4g/l | pH 4; Kutentha: 25 ° C | (1) ACD |
| Misa Solubility | 4.9g/l | pH 5; Kutentha: 25 ° C | (1) ACD |
| Misa Solubility | 4.2g/L | pH 6; Kutentha: 25 ° C | (1) ACD |
| Misa Solubility | 4.2g/L | pH 7; Kutentha: 25 ° C | (1) ACD |
| Misa Solubility | 4.2g/L | pH 8; Kutentha: 25 ° C | (1) ACD |
| Misa Solubility | 4.2g/L | pH 9; Kutentha: 25 ° C | (1) ACD |
| Misa Solubility | 4.2g/L | pH 10; Kutentha: 25 ° C | (1) ACD |
| Misa Solubility | 4.2g/L | Madzi Osasunthika pH 8.08; Kutentha: 25 ° C | (1) ACD |
| Molar Intrinsic Solubility | 0.013 mol / L | Kutentha: 25 ° C | (1) ACD |
| Molar Solubility | 3.07 mol / L | pH 1; Kutentha: 25 ° C | (1) ACD |
| Molar Solubility | 1.17 mol / L | pH 2; Kutentha: 25 ° C | (1) ACD |
| Molar Solubility | 0.17 mol / L | pH 3; Kutentha: 25 ° C | (1) ACD |
| Molar Solubility | 0.029 mol / L | pH 4; Kutentha: 25 ° C | (1) ACD |
| Molar Solubility | 0.015 mol / L | pH 5; Kutentha: 25 ° C | (1) ACD |
| Katundu | Mtengo | Mkhalidwe | Gwero |
| Molar Solubility | 0.013 mol / L | pH 6; Kutentha: 25 ° C | (1) ACD |
| Molar Solubility | 0.013 mol / L | pH 7; Kutentha: 25 ° C | (1) ACD |
| Molar Solubility | 0.013 mol / L | pH 8; Kutentha: 25 ° C | (1) ACD |
| Molar Solubility | 0.013 mol / L | pH 9; Kutentha: 25 ° C | (1) ACD |
| Molar Solubility | 0.013 mol / L | pH 10; Kutentha: 25 ° C | (1) ACD |
| Molar Solubility | 0.013 mol / L | Madzi Osasunthika pH 8.08; Kutentha: 25 ° C | (1) ACD |
| Kulemera kwa Maselo | 325.32 | ||
| pKa | 13.12±0.70 | Kutentha Kwambiri kwa Acid: 25 ° C | (1) ACD |
| pKa | 3.82±0.10 | Kutentha Kwambiri Kwambiri: 25 °C | (1) ACD |
| Kuthamanga kwa Vapor | 3.35 x 10-17 torr | Kutentha: 25 ° C | (1) ACD |
(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Katundu | Mtengo | Mkhalidwe | Gwero |
| Kuchulukana | 1.70±0.1 g/cm3 | Kutentha: 20 ° C; Press: 760 Torr | (1) ACD |
| Molar Volume | 191.2±7.0cm3/mol | Kutentha: 20 ° C; Press: 760 Torr | (1) ACD |
(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Katundu | Mtengo | Mkhalidwe | Gwero |
| Ma Bond Osinthasintha Mwaulere | 8 | (1) ACD | |
| H Olandira | 10 | (1) ACD | |
| H Opereka | 4 | (1) ACD | |
| H Chiwerengero cha Wopereka / Wolandira | 14 | (1) ACD | |
| logP | 0.462±0.647 | Kutentha: 25 ° C | (1) ACD |
| Kulemera kwa Maselo | 325.32 |
(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Katundu | Mtengo | Condition Source |
| Malo a Polar Surface | 138 a2 | (1) ACD |
(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Katundu | Mtengo | Mkhalidwe | Gwero |
| Boiling Point | 639.0±65.0 °C | Press: 760 Torr | (1) ACD |
| Enthalpy ya vaporization | 99.17±3.0 kJ/mol | Press: 760 Torr | (1) ACD |
| Pophulikira | 340.2±34.3 °C | (1) ACD |
(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra ilipo
1H NMR
13C NMR
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