![C31H32N2O8 Uridine, 5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2′-O-methyl- (9C I, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C31H32N2O8 Uridine, 5′-O-[bis (4-methoxyphenyl) phenylmethyl]-2′-O-methyl- (9C I, ACI) Aworan Ti a ṣe afihan](https://cdn.globalso.com/nvchem/C31H32N2O8-Uridine.jpg)
C31H32N2O8 Uridine, 5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2′-O-methyl- (9C I, ACI)
| Key Properties Properties | Iye | Ipo |
| Òṣuwọn Molikula | 560.60 | - |
| iwuwo (Asọtẹlẹ) | 1,35 ± 0,1 g / cm3 | Iwọn otutu: 20 °C;Tẹ: 760 Torr |
| pKa (Asọtẹlẹ) | 9.39 ± 0.10 | Pupọ Epo otutu: 25 °C |
SILES Canonical O=C1C=CN(C(=O)N1)C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C= C5)C (O) C2OC
Isomeric SMILES C (OC [C@H] 1O[C @ H] ([C @ H] (OC) [C@@H] 1O) N2C(=O)NC(=O)C=C2)(C3= CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChi
InChi=1S/C31H32N2O8/c1-37-23-13-9-21(10-14-23)31(20-7-5-4-6-8-20,22-11-15-24(38- 2)16-12-22)40-19-25-27(35)28(39-3)29(41-25)
33-18-17-26(34)32-30(33)36/h4-18,25,27-29,35H,19H2,1-3H3,(H,32,34,36)/t25-,27 -,28-,29-/m1/s1
InChi Key
MFDHAVFJDSRPKC-YXINZVNLSA-N
2 Awọn orukọ miiran fun nkan yii
5′-O-[Bis (4-methoxyphenyl) phenylmethyl] -2′-O-methyluridine (ACI);5'-O- (4,4'-Dimethoxytril) -2'-O-methyluridine
Spectra wa
1H NMR
Ibi
| Awọn ohun-ini ti o wa |
| Ti ibi |
| Kemikali |
| iwuwo |
| Lipinski |
| Ilana Jẹmọ |
Ti ibi
| Ohun ini | Iye | Ipo | Orisun |
| Bioconcentration ifosiwewe | 1240 | pH 1;Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1240 | pH 2;Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1240 | pH 3;Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1240 | pH 4;Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1240 | pH 5;Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1240 | pH 6;Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1230 | pH 7;Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1190 | pH 8;Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 861 | pH 9;Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 238 | 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)
Kemikali
| Ohun ini | Iye | Ipo | Orisun |
| Koc | 5690 | pH 1;Iwọn otutu: 25 °C | (1) ACD |
| Koc | 5690 | pH 2;Iwọn otutu: 25 °C | (1) ACD |
| Koc | 5690 | pH 3;Iwọn otutu: 25 °C | (1) ACD |
| Koc | 5690 | pH 4;Iwọn otutu: 25 °C | (1) ACD |
| Koc | 5690 | pH 5;Iwọn otutu: 25 °C | (1) ACD |
| Koc | 5690 | pH 6;Iwọn otutu: 25 °C | (1) ACD |
| Koc | 5670 | pH 7;Iwọn otutu: 25 °C | (1) ACD |
| Koc | 5450 | pH 8;Iwọn otutu: 25 °C | (1) ACD |
| Ohun ini | Iye | Ipo | Orisun |
| Koc | 3960 | pH 9;Iwọn otutu: 25 °C | (1) ACD |
| Koc | 1100 | pH 10;Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.37 | pH 1;Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.37 | pH 2;Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.37 | pH 3;Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.37 | pH 4;Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.37 | pH 5;Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.37 | pH 6;Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.37 | pH 7;Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.35 | pH 8;Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.21 | pH 9;Iwọn otutu: 25 °C | (1) ACD |
| logD | 3.66 | pH 10;Iwọn otutu: 25 °C | (1) ACD |
| logP | 4.372 ± 0.582 | Iwọn otutu: 25 °C | (1) ACD |
| Ibi Isoju Agbekale | 3,7 x 10-4 g/L | Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 3,7 x 10-4 g/L | pH 1;Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 3,7 x 10-4 g/L | pH 2;Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 3,7 x 10-4 g/L | pH 3;Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 3,7 x 10-4 g/L | pH 4;Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 3,7 x 10-4 g/L | pH 5;Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 3,7 x 10-4 g/L | pH 6;Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 3,7 x 10-4 g/L | pH 7;Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 3,8 x 10-4 g/L | pH 8;Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 5.3 x 10-4 g/L | pH 9;Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 1,9 x 10-3 g/L | pH 10;Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 3,7 x 10-4 g/L | Omi ti ko ni ipamọ pH 6.99;Iwọn otutu: 25 °C | (1) ACD |
| Solubility Inu inu Molar | 6,6 x 10-7 mol/L | Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 6,6 x 10-7 mol/L | pH 1;Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 6,6 x 10-7 mol/L | pH 2;Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 6,6 x 10-7 mol/L | pH 3;Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 6,6 x 10-7 mol/L | pH 4;Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 6,6 x 10-7 mol/L | pH 5;Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 6,6 x 10-7 mol/L | pH 6;Iwọn otutu: 25 °C | (1) ACD |
| Ohun ini | Iye | Ipo | Orisun |
| Solubility Molar | 6,6 x 10-7 mol/L | pH 7;Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 6,8 x 10-7 mol/L | pH 8;Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 9.4 x 10-7 mol/L | pH 9;Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 3.4 x 10-6 mol/L | pH 10;Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 6,6 x 10-7 mol/L | Omi ti ko ni ipamọ pH 6.99;Iwọn otutu: 25 °C | (1) ACD |
| Òṣuwọn Molikula | 560.60 | ||
| pKa | 9.39 ± 0.10 | Pupọ Epo otutu: 25 °C | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
iwuwo
| Ohun ini | Iye | Ipo | Orisun |
| iwuwo | 1,35 ± 0,1 g / cm3 | Iwọn otutu: 20 °C;Tẹ: 760 Torr | (1) ACD |
| Iwọn didun Molar | 412,9 ± 5,0 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)
Lipinski
| Ohun ini | Iye | Ipo | Orisun |
| Larọwọto Rotatable Bonds | 11 | (1) ACD | |
| H Awọn olugba | 10 | (1) ACD | |
| H Awọn oluranlọwọ | 2 | (1) ACD | |
| H Oluranlọwọ / Olugba Apapọ | 12 | (1) ACD | |
| logP | 4.372 ± 0.582 | Iwọn otutu: 25 °C | (1) ACD |
| Òṣuwọn Molikula | 560.60 |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Ilana Jẹmọ
| Ohun ini | Iye | Ipo | Orisun |
| Pola dada Area | 116 A2 | (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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