C13H19N5O6 Guanosine, 2′-O-(2-methoxyethyl)- (9CI, ACI)
Nọmba iforukọsilẹ CAS
473278-54-5
| Key Properties Properties | Iye | Ipo |
| Òṣuwọn Molikula | 341.32 | - |
| Oju Ise (Asọtẹlẹ) | 715,0 ± 70,0 °C | Tẹ: 760 Torr |
| iwuwo (Asọtẹlẹ) | 1,81 ± 0,1 g / cm3 | Iwọn otutu: 20 °C; Tẹ: 760 Torr |
| pKa (Asọtẹlẹ) | 13.20 ± 0.70 | Pupọ Epo otutu: 25 °C |
Ẹ̀RẸ̀ KẸ̀LẸ̀
O=C1N=C(N)NC2=C1N=CN2C3OC(CO)C(O)C3OCCOC
ISOMERIC SMILES
O(CCOC)[C@H]1[C@@H](O[C@H](CO)[C@H]1O)N2C3=C(N=C2)C(=O)N=C(N)N3
InChi
InChi= 1S/C13H19N5O6/c1-22-2-3-23-9-8(20)6(4-19)24-12(9)18-5-15-7- 10 (18) 16-13 (14) 17-11 (7) 21 / h5-6,8-9,12,19-20H,2-4H2,1H3,(H3, 14,16,17,21)/t6-,8-,9-,12-/m1/s1
InChi Key
DLLBJSLIKOKFHE-WOUKDFQISA-N
1 Oruko miiran fun Ohun elo yii
2′-O-(2-Methoxyethyl) guanosine (ACI)
Awọn ohun-ini ti o wa
Opitika ati tuka
Gbona
| Ohun ini | Iye | Ipo | Orisun |
| Opitika Yiyi Power | -51 deg-ml/g-dm | c: 1.4 g/100ml; Ohun elo: Dichloromethane; λ: 589.3 nm; Iwọn otutu: 25 °C | (1) CAS |
| Opitika Yiyi Power | Wo Ẹkunrẹrẹ Ọrọ | (2) CAS |
(1) Wen, Ke; Iwe akosile ti Kemistri Organic, (2002), 67 (22), 7887-7889, CAplus
(2) Wen, Ke; Iwe akosile ti Kemistri Organic, (2002), 67 (22), 7887-7889, CAplus
| Ohun ini | Iye | Orisun ipo |
| Ojuami Iyo | Wo Ẹkunrẹrẹ Ọrọ | (1) CAS |
(1) Taj, Shabbir Ali S.; Nucleosides, Nucleotides & Nucleic Acids, (2008), 27(9), 1024-1033, CAplus
Spectra wa
1 H NMR
13 C NMR
IR
Awọn ohun-ini ti o wa
Ti ibi
Kemikali
iwuwo
Lipinski
Ilana Jẹmọ
Gbona
| Ohun ini | Iye | Ipo | Orisun |
| Bioconcentration ifosiwewe | 1.0 | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Ohun ini | Iye | Ipo | Orisun |
| Bioconcentration ifosiwewe | 1.0 | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 10; Iwọn otutu: 25 °C | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ohun ini | Iye | Ipo | Orisun |
| Koc | 1.0 | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 1.0 | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 4.27 | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 8.49 | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 9.43 | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 9.54 | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 9.55 | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 9.55 | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 9.55 | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 9.54 | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| logD | -2.65 | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| logD | -1.84 | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| logD | -1.08 | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.78 | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.74 | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.73 | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.73 | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.73 | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.73 | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.73 | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| logP | -0.730 ± 0.568 | Iwọn otutu: 25 °C | (1) ACD |
| Ibi Isoju Agbekale | 0.44 g/L | Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 38 g/L | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 5.5 g/L | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Ohun ini | Iye | Ipo | Orisun |
| Ibi Solubility | 0.96 g/L | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 0.48 g/L | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 0.44 g/L | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 0.44 g/L | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 0.44 g/L | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 0.44 g/L | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 0.44 g/L | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 0.44 g/L | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 0.44 g/L | Omi ti a ko fi silẹ pH 7.20; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Inu inu Molar | 1.3 x 10-3 mol/L | Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.11 mol/L | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.016 mol/L | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 2.8 x 10-3 mol/L | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1,4 x 10-3 mol/L | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1.3 x 10-3 mol/L | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1.3 x 10-3 mol/L | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1.3 x 10-3 mol/L | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1.3 x 10-3 mol/L | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1.3 x 10-3 mol/L | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1.3 x 10-3 mol/L | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1.3 x 10-3 mol/L | Omi ti a ko fi silẹ pH 7.20; Iwọn otutu: 25 °C | (1) ACD |
| Òṣuwọn Molikula | 341.32 | ||
| pKa | 13.20 ± 0.70 | Pupọ Epo otutu: 25 °C | (1) ACD |
| pKa | 3.00 ± 0.20 | Pupọ Ipilẹ otutu: 25 °C | (1) ACD |
| Oru Ipa | 1,86 x 10-21 Torr | Iwọn otutu: 25 °C | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ohun ini | Iye | Ipo | Orisun |
| iwuwo | 1,81 ± 0,1 g / cm3 | Iwọn otutu: 20 °C; Tẹ: 760 Torr | (1) ACD |
| Iwọn didun Molar | 188,5 ± 7,0 cm3 / mol | Iwọn otutu: 20 °C; Tẹ: 760 Torr | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ohun ini | Iye | Ipo | Orisun |
| Larọwọto Rotatable Bonds | 8 | (1) ACD | |
| H Awọn olugba | 11 | (1) ACD | |
| H Awọn oluranlọwọ | 5 | (1) ACD | |
| H Oluranlọwọ / Olugba Apapọ | 16 | (1) ACD | |
| logP | -0.730 ± 0.568 | Iwọn otutu: 25 °C | (1) ACD |
| Òṣuwọn Molikula | 341.32 |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ohun ini | Iye | Orisun ipo |
| Pola dada Area | 153 A2 | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ohun ini | Iye | Ipo | Orisun |
| Ojuami farabale | 715,0 ± 70,0 °C | Tẹ: 760 Torr | (1) ACD |
| Enthalpy ti Vaporization | 109,72 ± 3,0 kJ / mol | Tẹ: 760 Torr | (1) ACD |
| Oju filaṣi | 386,2 ± 35,7 °C | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra wa
1H NMR
13C NMR
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