118 Re36H44N2O8Si Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-[(1,1- dimethylethyl)dimethylsilyl]- (9CI, ACI)

oloa

118 Re36H44N2O8Si Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-[(1,1- dimethylethyl)dimethylsilyl]- (9CI, ACI)

Fa'amatalaga Autu:


Fa'amatalaga Oloa

Faailoga o oloa

Meatotino faaletino

Meatotino Faaletino Autu Taua Tulaga
Molecular Weight 660.83 -
To'atele (Va'ai) 1.24±0.1g/cm3 Maalili: 20 °C; Lomitusi: 760 Torr
pKa (vala'aina) 9.39±0.10 Le Tele o le Acid Temp: 25 °C

Isi Igoa ma Fa'ailoaga

O'O'ITA'I 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)C2O[Si](C)(C)C(C)(C)C
Isomeric SMILES
C(OC[C@H]1O[C@H]([C@H](O[Si](C(C)(C)C)(C)C)[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/C36H44N2O8Si/c1-35(2,3)47(6,7)46-32-31(40)29(45-33(32)38-22-21-30(39)37-34( 38)41)23-44-36(24-11-9-8-10-12-24,25-13- 17-27(42-4)18-14-25)26-15-19-28( 43-5)20-16-26/h8-22,29,31-33,40H,23H2,1-7H3,(H,37,39,41)/t29-,31-,32-,33-/ m1/s1
InChI Ki
KVHQIELPHWJPSY-WXQJYUTRSA-N
2 Isi Igoa mo lea Mea
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]-2′-O-[(1,1-dimethylethyl)dimethylsilyl]uridine (ACI); 2′-O-tert-Butyldimethylsilyl-5′-O-(4,4′- dimethoxytriyl)uridine

Fa'ata'ita'iga Spectra

Spectra avanoa
1H NMR
13C NMR
Hetero NMR
Misasa

Meatotino Va'ai

Meatotino avanoa
Fa'aolaola
Kemisi
Malosi
Lipinski
Fauga Faatatau

Fa'aolaola

Meatotino Taua Tulaga Punavai
Bioconcentration Factor 2.21 x 105 pH 1; Maalili: 25 °C (1) ACD
Bioconcentration Factor 2.21 x 105 pH 2; Maalili: 25 °C (1) ACD
Bioconcentration Factor 2.21 x 105 pH 3; Maalili: 25 °C (1) ACD
Bioconcentration Factor 2.21 x 105 pH 4; Maalili: 25 °C (1) ACD
Bioconcentration Factor 2.21 x 105 pH 5; Maalili: 25 °C (1) ACD
Bioconcentration Factor 2.21 x 105 pH 6; Maalili: 25 °C (1) ACD
Bioconcentration Factor 2.20 x 105 pH 7; Maalili: 25 °C (1) ACD
Bioconcentration Factor 2.12 x 105 pH 8; Maalili: 25 °C (1) ACD
Bioconcentration Factor 1.54 x 105 pH 9; Maalili: 25 °C (1) ACD
Bioconcentration Factor 42500 pH 10; Maalili: 25 °C (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Kemisi

Meatotino Taua Tulaga Punavai
Koc 2.33 x 105 pH 1; Maalili: 25 °C (1) ACD
Koc 2.33 x 105 pH 2; Maalili: 25 °C (1) ACD
Koc 2.33 x 105 pH 3; Maalili: 25 °C (1) ACD
Koc 2.33 x 105 pH 4; Maalili: 25 °C (1) ACD
Koc 2.33 x 105 pH 5; Maalili: 25 °C (1) ACD
Koc 2.33 x 105 pH 6; Maalili: 25 °C (1) ACD

 

Meatotino Taua Tulaga Punavai
Koc 2.32 x 105 pH 7; Maalili: 25 °C (1) ACD
Koc 2.23 x 105 pH 8; Maalili: 25 °C (1) ACD
Koc 1.62 x 105 pH 9; Maalili: 25 °C (1) ACD
Koc 44800 pH 10; Maalili: 25 °C (1) ACD
ogalaauD 7.33 pH 1; Maalili: 25 °C (1) ACD
ogalaauD 7.33 pH 2; Maalili: 25 °C (1) ACD
ogalaauD 7.33 pH 3; Maalili: 25 °C (1) ACD
ogalaauD 7.33 pH 4; Maalili: 25 °C (1) ACD
ogalaauD 7.33 pH 5; Maalili: 25 °C (1) ACD
ogalaauD 7.33 pH 6; Maalili: 25 °C (1) ACD
ogalaauD 7.33 pH 7; Maalili: 25 °C (1) ACD
ogalaauD 7.32 pH 8; Maalili: 25 °C (1) ACD
ogalaauD 7.18 pH 9; Maalili: 25 °C (1) ACD
ogalaauD 6.62 pH 10; Maalili: 25 °C (1) ACD
logP 7.334±0.643 Maalili: 25 °C (1) ACD
Mass Intrinsic Solubility 3.5 x 10-5 g/L Maalili: 25 °C (1) ACD
Mass Solubility 3.5 x 10-5 g/L pH 1; Maalili: 25 °C (1) ACD
Mass Solubility 3.5 x 10-5 g/L pH 2; Maalili: 25 °C (1) ACD
Mass Solubility 3.5 x 10-5 g/L pH 3; Maalili: 25 °C (1) ACD
Mass Solubility 3.5 x 10-5 g/L pH 4; Maalili: 25 °C (1) ACD
Mass Solubility 3.5 x 10-5 g/L pH 5; Maalili: 25 °C (1) ACD
Mass Solubility 3.5 x 10-5 g/L pH 6; Maalili: 25 °C (1) ACD
Mass Solubility 3.5 x 10-5 g/L pH 7; Maalili: 25 °C (1) ACD
Mass Solubility 3.6 x 10-5 g/L pH 8; Maalili: 25 °C (1) ACD
Mass Solubility 5.0 x 10-5 g/L pH 9; Maalili: 25 °C (1) ACD
Mass Solubility 1.9 x 10-4 g/L pH 10; Maalili: 25 °C (1) ACD
Mass Solubility 3.5 x 10-5 g/L Suavai e le fa'afefe pH 7.00; Maalili: 25 °C (1) ACD
Molar Intrinsic Solubility 5.3 x 10-8 mol/L Maalili: 25 °C (1) ACD
Molar Solubility 5.3 x 10-8 mol/L pH 1; Maalili: 25 °C (1) ACD
Molar Solubility 5.3 x 10-8 mol/L pH 2; Maalili: 25 °C (1) ACD
Molar Solubility 5.3 x 10-8 mol/L pH 3; Maalili: 25 °C (1) ACD
Molar Solubility 5.3 x 10-8 mol/L pH 4; Maalili: 25 °C (1) ACD

 

Meatotino Taua Tulaga Punavai
Molar Solubility 5.3 x 10-8 mol/L pH 5; Maalili: 25 °C (1) ACD
Molar Solubility 5.3 x 10-8 mol/L pH 6; Maalili: 25 °C (1) ACD
Molar Solubility 5.3 x 10-8 mol/L pH 7; Maalili: 25 °C (1) ACD
Molar Solubility 5.5 x 10-8 mol/L pH 8; Maalili: 25 °C (1) ACD
Molar Solubility 7.6 x 10-8 mol/L pH 9; Maalili: 25 °C (1) ACD
Molar Solubility 2.8 x 10-7 mol/L pH 10; Maalili: 25 °C (1) ACD
Molar Solubility 5.3 x 10-8 mol/L Suavai e le fa'afefe pH 7.00; Maalili: 25 °C (1) ACD
Molecular Weight 660.83    
pKa 9.39±0.10 Le Tele o le Acid Temp: 25 °C (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Malosi

Meatotino Taua Tulaga Punavai
Malosi 1.24±0.1g/cm3 Maalili: 20 °C; Lomitusi: 760 Torr (1) ACD
Molar Volume 528.8±5.0 cm3/mol Maalili: 20 °C; Lomitusi: 760 Torr (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Meatotino Taua Tulaga Punavai
Noanoaga e mafai ona fesuia'i saoloto 13   (1) ACD
H Tagata talia 10   (1) ACD
H Donors 2   (1) ACD
H Fa'ameaalofa/Tagata Talia 12   (1) ACD
logP 7.334±0.643 Maalili: 25 °C (1) ACD
Molecular Weight 660.83    

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Fauga Faatatau

Meatotino Taua

Tulaga

Punavai
Polar Surface Area 116 A2 (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Va'aiga Spectra

Spectra avanoa
1H NMR
13C NMR


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