C13H19N5O5 Adenosine, 2′-O-(2-methoxyethyl)- (9CI, ACI)
Lambar Rijistar CAS
168427-74-5
| Mabuɗin Abubuwan Jiki | Daraja | Sharadi |
| Nauyin Kwayoyin Halitta | 325.32 | - |
| Wurin tafasa (An annabta) | 639.0± 65.0 °C | Latsa: 760 Torr |
| Girma (An annabta) | 1.70± 0.1 g/cm3 | Zazzabi: 20 ° C; Latsa: 760 Torr |
| pKa (An annabta) | 13.12± 0.70 | Mafi yawan zafin jiki: 25 ° C |
MURMUSHI na Canonical
OCC1OC(N2C= NC=3C(= NC= NC32)N)C(OCCOC)C1O
MURMUSHI
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 Wani Sunan Wannan Abu
2'-O(2-Methoxyethyl) adenosine (ACI)
Spectra akwai
1 H NMR
13 C NMR
Properties akwai
Halittu
Chemical
Yawan yawa
Lipinski
Tsarin Yanayi
Thermal
| Dukiya | Daraja | Sharadi | Source |
| Factor na Bioconcentration | 1.0 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.0 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.0 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.0 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.18 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.31 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.32 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.32 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.32 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.32 | pH 10; Zazzabi: 25 ° C | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Dukiya | Daraja | Sharadi | Source |
| Koc | 1.0 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Koc | 1.0 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Koc | 3.39 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Koc | 19.4 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Koc | 38.0 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Koc | 42.0 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Koc | 42.5 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Dukiya | Daraja | Sharadi | Source |
| Koc | 42.5 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Koc | 42.5 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Koc | 42.5 | pH 10; Zazzabi: 25 ° C | (1) ACD |
| logD | -1.94 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| logD | -1.48 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| logD | -0.64 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| logD | 0.12 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| logD | 0.41 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| logD | 0.46 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| logD | 0.46 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| logD | 0.46 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| logD | 0.46 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| logD | 0.46 | pH 10; Zazzabi: 25 ° C | (1) ACD |
| logP | 0.462± 0.647 | Zazzabi: 25 ° C | (1) ACD |
| Mass Intrinsic Solubility | 4.2 g/l | Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 999 g/l | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 381 g/l | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 55 g/l | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 9.4g/l | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 4.9g/l | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 4.2 g/l | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 4.2 g/l | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 4.2 g/l | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 4.2 g/l | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 4.2 g/l | pH 10; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 4.2 g/l | Ruwan da ba a buguwa pH 8.08; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Ciki na Molar | 0.013 mol/L | Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 3.07 mol/L | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 1.17 mol/L | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 0.17 mol/L | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 0.029 mol/L | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 0.015 mol/L | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Dukiya | Daraja | Sharadi | Source |
| Solubility na Molar | 0.013 mol/L | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 0.013 mol/L | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 0.013 mol/L | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 0.013 mol/L | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 0.013 mol/L | pH 10; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 0.013 mol/L | Ruwan da ba a buguwa pH 8.08; Zazzabi: 25 ° C | (1) ACD |
| Nauyin Kwayoyin Halitta | 325.32 | ||
| pKa | 13.12± 0.70 | Mafi yawan zafin jiki: 25 ° C | (1) ACD |
| pKa | 3.82± 0.10 | Mafi Asalin Zazzabi: 25 ° C | (1) ACD |
| Ruwan Ruwa | 3.35 x 10-17 Torr | Zazzabi: 25 ° C | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Dukiya | Daraja | Sharadi | Source |
| Yawan yawa | 1.70± 0.1 g/cm3 | Zazzabi: 20 ° C; Latsa: 760 Torr | (1) ACD |
| Ƙarar Molar | 191.2± 7.0 cm3/mol | Zazzabi: 20 ° C; Latsa: 760 Torr | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Dukiya | Daraja | Sharadi | Source |
| Ƙimar Rarraba Kyauta | 8 | (1) ACD | |
| H Masu karɓa | 10 | (1) ACD | |
| H Masu Ba da taimako | 4 | (1) ACD | |
| H Donor/Acceptor Sum | 14 | (1) ACD | |
| logP | 0.462± 0.647 | Zazzabi: 25 ° C | (1) ACD |
| Nauyin Kwayoyin Halitta | 325.32 |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Dukiya | Daraja | Tushen yanayi |
| Wuri Mai Girma | 138 A2 | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Dukiya | Daraja | Sharadi | Source |
| Wurin Tafasa | 639.0± 65.0 °C | Latsa: 760 Torr | (1) ACD |
| Enthalpy na Vaporization | 99.17± 3.0 kJ/mol | Latsa: 760 Torr | (1) ACD |
| Wurin Flash | 340.2± 34.3 °C | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra akwai
1H NMR
13C NMR
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