C31H32N2O8 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyl- (9C I, ACI)

hua

C31H32N2O8 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyl- (9C I, ACI)

Mōhiohio Taketake:


Taipitopito Hua

Tohu Hua

Ngā āhuatanga ā-tinana

Nga Ahuatanga Tinana Matua Uara Tikanga
Taumaha Molecular 560.60 -
Kiato (I Matapaetia) 1.35±0.1 g/cm3 Te Mahana: 20 °C;Perehi: 760 Torr
pKa (I Matapaetia) 9.39±0.10 Te Mahana Waiwawa Nui: 25 °C

Ētahi atu Ingoa me nga Kaitohu

MATE 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
NGĀ ATA ISOMERC 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
Kī InChI
MFDHAVFJDSRPKC-YXINZVNLSA-N
2 Ētahi atu Ingoa mō tēnei Matū
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyluridine (ACI);5′-O-(4,4′-Dimethoxytrityl)-2′-O-methyluridine

Spectra Whakamatau

Kei te waatea te Spectra
1H NMR
Mass

Nga Taonga Matapae

Nga rawa e waatea ana
Koiora
Te matū
Kiato
Lipinski
Hanganga e Pa ana

Koiora

Taonga Uara Tikanga Puna
Tauwehe Bioconcentration 1240 pH 1;Te Mahana: 25 °C (1) ACD
Tauwehe Bioconcentration 1240 pH 2;Te Mahana: 25 °C (1) ACD
Tauwehe Bioconcentration 1240 pH 3;Te Mahana: 25 °C (1) ACD
Tauwehe Bioconcentration 1240 pH 4;Te Mahana: 25 °C (1) ACD
Tauwehe Bioconcentration 1240 pH 5;Te Mahana: 25 °C (1) ACD
Tauwehe Bioconcentration 1240 pH 6;Te Mahana: 25 °C (1) ACD
Tauwehe Bioconcentration 1230 pH 7;Te Mahana: 25 °C (1) ACD
Tauwehe Bioconcentration 1190 pH 8;Te Mahana: 25 °C (1) ACD
Tauwehe Bioconcentration 861 pH 9;Te Mahana: 25 °C (1) ACD
Tauwehe Bioconcentration 238 pH 10;Te Mahana: 25 °C (1) ACD

(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)

Te matū

Taonga Uara Tikanga Puna
Koc 5690 pH 1;Te Mahana: 25 °C (1) ACD
Koc 5690 pH 2;Te Mahana: 25 °C (1) ACD
Koc 5690 pH 3;Te Mahana: 25 °C (1) ACD
Koc 5690 pH 4;Te Mahana: 25 °C (1) ACD
Koc 5690 pH 5;Te Mahana: 25 °C (1) ACD
Koc 5690 pH 6;Te Mahana: 25 °C (1) ACD
Koc 5670 pH 7;Te Mahana: 25 °C (1) ACD
Koc 5450 pH 8;Te Mahana: 25 °C (1) ACD

 

Taonga Uara Tikanga Puna
Koc 3960 pH 9;Te Mahana: 25 °C (1) ACD
Koc 1100 pH 10;Te Mahana: 25 °C (1) ACD
rangitakiD 4.37 pH 1;Te Mahana: 25 °C (1) ACD
rangitakiD 4.37 pH 2;Te Mahana: 25 °C (1) ACD
rangitakiD 4.37 pH 3;Te Mahana: 25 °C (1) ACD
rangitakiD 4.37 pH 4;Te Mahana: 25 °C (1) ACD
rangitakiD 4.37 pH 5;Te Mahana: 25 °C (1) ACD
rangitakiD 4.37 pH 6;Te Mahana: 25 °C (1) ACD
rangitakiD 4.37 pH 7;Te Mahana: 25 °C (1) ACD
rangitakiD 4.35 pH 8;Te Mahana: 25 °C (1) ACD
rangitakiD 4.21 pH 9;Te Mahana: 25 °C (1) ACD
rangitakiD 3.66 pH 10;Te Mahana: 25 °C (1) ACD
rangitakiP 4.372±0.582 Te Mahana: 25 °C (1) ACD
Te Wairewa o roto 3.7 x 10-4 g/L Te Mahana: 25 °C (1) ACD
Wairewa Papatipu 3.7 x 10-4 g/L pH 1;Te Mahana: 25 °C (1) ACD
Wairewa Papatipu 3.7 x 10-4 g/L pH 2;Te Mahana: 25 °C (1) ACD
Wairewa Papatipu 3.7 x 10-4 g/L pH 3;Te Mahana: 25 °C (1) ACD
Wairewa Papatipu 3.7 x 10-4 g/L pH 4;Te Mahana: 25 °C (1) ACD
Wairewa Papatipu 3.7 x 10-4 g/L pH 5;Te Mahana: 25 °C (1) ACD
Wairewa Papatipu 3.7 x 10-4 g/L pH 6;Te Mahana: 25 °C (1) ACD
Wairewa Papatipu 3.7 x 10-4 g/L pH 7;Te Mahana: 25 °C (1) ACD
Wairewa Papatipu 3.8 x 10-4 g/L pH 8;Te Mahana: 25 °C (1) ACD
Wairewa Papatipu 5.3 x 10-4 g/L pH 9;Te Mahana: 25 °C (1) ACD
Wairewa Papatipu 1.9 x 10-3 g/L pH 10;Te Mahana: 25 °C (1) ACD
Wairewa Papatipu 3.7 x 10-4 g/L Te Wai Kore Kore Te pH 6.99;Te Mahana: 25 °C (1) ACD
Molar Intrinsic Solubility 6.6 x 10-7 mol/L Te Mahana: 25 °C (1) ACD
Molar Solubility 6.6 x 10-7 mol/L pH 1;Te Mahana: 25 °C (1) ACD
Molar Solubility 6.6 x 10-7 mol/L pH 2;Te Mahana: 25 °C (1) ACD
Molar Solubility 6.6 x 10-7 mol/L pH 3;Te Mahana: 25 °C (1) ACD
Molar Solubility 6.6 x 10-7 mol/L pH 4;Te Mahana: 25 °C (1) ACD
Molar Solubility 6.6 x 10-7 mol/L pH 5;Te Mahana: 25 °C (1) ACD
Molar Solubility 6.6 x 10-7 mol/L pH 6;Te Mahana: 25 °C (1) ACD

 

Taonga Uara Tikanga Puna
Molar Solubility 6.6 x 10-7 mol/L pH 7;Te Mahana: 25 °C (1) ACD
Molar Solubility 6.8 x 10-7 mol/L pH 8;Te Mahana: 25 °C (1) ACD
Molar Solubility 9.4 x 10-7 mol/L pH 9;Te Mahana: 25 °C (1) ACD
Molar Solubility 3.4 x 10-6 mol/L pH 10;Te Mahana: 25 °C (1) ACD
Molar Solubility 6.6 x 10-7 mol/L Te Wai Kore Kore Te pH 6.99;Te Mahana: 25 °C (1) ACD
Taumaha Molecular 560.60    
pKa 9.39±0.10 Te Mahana Waiwawa Nui: 25 °C (1) ACD

(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)

Kiato

Taonga Uara Tikanga Puna
Kiato 1.35±0.1 g/cm3 Te Mahana: 20 °C;Perehi: 760 Torr (1) ACD
Rōrahi Moara 412.9±5.0 cm3/mol Te Mahana: 20 °C;Perehi: 760 Torr (1) ACD

(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Taonga Uara Tikanga Puna
Nga here e taea te huri noa 11   (1) ACD
H Nga Kaiwhiwhi 10   (1) ACD
H Nga Kaituku 2   (1) ACD
H Tapeke Kaituku/Kaiwhiwhi 12   (1) ACD
rangitakiP 4.372±0.582 Te Mahana: 25 °C (1) ACD
Taumaha Molecular 560.60    

(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)

Hanganga e Pa ana

Taonga Uara

Tikanga

Puna
Rohe Mata Polar 116 A2 (1) ACD

(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)

Tohua Matapae

Kei te waatea te Spectra
1H NMR
13C NMR


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