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C31H32N2O8 Uridine, 5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2'-O-methyl- (9C I, ACI)
| Njirimara anụ ahụ igodo | Uru | Ọnọdụ |
| Ibu molekụla | 560.60 | - |
| Njupụta (buru amụma) | 1.35±0.1 g/cm3 | Okpomọkụ: 20 °C;Pịa: 760 Torr |
| pKa (buru amụma) | 9.39±0.10 | Okpomọkụ kachasị acidic: 25 Celsius |
Canonical SILES 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 Igodo
MFDHAVFJDSRPKC-YXINZVNLSA-N
2 Aha ndị ọzọ maka ihe a
5′-O-[Bis (4-methoxyphenyl) phenylmethyl] -2′-O-methyluridine (ACI);5'-O- (4,4'-Dimethoxytril) -2'-O-methyluridine
Spectra dị
1H NMR
Mass
| Ngwongwo dị |
| Usoro ndu |
| Chemical |
| Njupụta |
| Lipinski |
| Ọdịdị metụtara |
Usoro ndu
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Ihe kpatara bioconcentration | 1240 | pH 1;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1240 | pH 2;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1240 | pH 3;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1240 | pH 4;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1240 | pH 5;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1240 | pH 6;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1230 | pH 7;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1190 | pH 8;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 861 | pH 9;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 238 | pH 10;Okpomọkụ: 25 Celsius C | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Chemical
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Koc | 5690 | pH 1;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 5690 | pH 2;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 5690 | pH 3;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 5690 | pH 4;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 5690 | pH 5;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 5690 | pH 6;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 5670 | pH 7;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 5450 | pH 8;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Koc | 3960 | pH 9;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 1100 | pH 10;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.37 | pH 1;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.37 | pH 2;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.37 | pH 3;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.37 | pH 4;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.37 | pH 5;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.37 | pH 6;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.37 | pH 7;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.35 | pH 8;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 4.21 | pH 9;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 3.66 | pH 10;Okpomọkụ: 25 Celsius C | (1) ACD |
| logP | 4.372±0.582 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ọkachamara Solubility dị n'ime | 3.7 x 10-4 g/L | Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.7 x 10-4 g/L | pH 1;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.7 x 10-4 g/L | pH 2;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.7 x 10-4 g/L | pH 3;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.7 x 10-4 g/L | pH 4;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.7 x 10-4 g/L | pH 5;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.7 x 10-4 g/L | pH 6;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.7 x 10-4 g/L | pH 7;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.8 x 10-4 g/L | pH 8;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 5.3 x 10-4 g/L | pH 9;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.9 x 10-3 g/L | pH 10;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.7 x 10-4 g/L | Mmiri na-enweghị atụ pH 6.99;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility dị n'ime Molar | 6.6 x 10-7 mol/L | Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 6.6 x 10-7 mol/L | pH 1;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 6.6 x 10-7 mol/L | pH 2;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 6.6 x 10-7 mol/L | pH 3;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 6.6 x 10-7 mol/L | pH 4;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 6.6 x 10-7 mol/L | pH 5;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 6.6 x 10-7 mol/L | pH 6;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Solubility Molar | 6.6 x 10-7 mol/L | pH 7;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 6.8 x 10-7 mol/L | pH 8;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 9.4 x 10-7 mol/L | pH 9;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 3.4 x 10-6 mol/L | pH 10;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 6.6 x 10-7 mol/L | Mmiri na-enweghị atụ pH 6.99;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 560.60 | ||
| pKa | 9.39±0.10 | Okpomọkụ kachasị acidic: 25 Celsius | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Njupụta
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Njupụta | 1.35±0.1 g/cm3 | Okpomọkụ: 20 °C;Pịa: 760 Torr | (1) ACD |
| Olu Molar | 412.9±5.0 cm3/mol | Okpomọkụ: 20 °C;Pịa: 760 Torr | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Nkwekọrịta na-agbanwe agbanwe n'efu | 11 | (1) ACD | |
| H Ndị nnabata | 10 | (1) ACD | |
| H Ndị na-enye onyinye | 2 | (1) ACD | |
| H Donor/Anabata Nchikota | 12 | (1) ACD | |
| logP | 4.372±0.582 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 560.60 |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Ọdịdị metụtara
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Mpaghara elu elu | 116 A2 | (1) ACD | |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra dị
1H NMR
13C NMR
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