C34H39N3O8 Cytidine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2-methox yethyl)-5-methyl- (9CI, ACI)

oloa

C34H39N3O8 Cytidine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2-methox yethyl)-5-methyl- (9CI, ACI)

Fa'amatalaga Autu:


Fa'amatalaga Oloa

Faailoga o oloa

Meatotino faaletino

Meatotino Faaletino Autu Taua Tulaga
Molecular Weight 617.69 -
Fa'apuna (Va'ai) 762.6±70.0 °C Lomitusi: 760 Torr
To'atele (Va'ai) 1.27±0.1 g/cm3 Maalili: 20 °C; Lomitusi: 760 Torr
pKa (vala'aina) 13.31±0.70 Le Tele o le Asi Sua: 25 °C

Isi Igoa ma Fa'ailoaga

ATA AFATA O=C1N=C(N)C(=CN1C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C=C5) C(O)C2OCCOC)C
Isomeric SMILES C(OC[C@H]1O[C@H]([C@H](OCCOC)[C@@H]1O)N2C(=O)N=C(N)C(C)=C2 )(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChI
InChI=1S/C34H39N3O8/c1-22-20-37(33(39)36-31(22)35)32-30(43-19-18-40-2)29(38)28(45-32) 21-44-34(23-8-6-5-7-9-23,24-10-14-26(4 1-3)15-11-24)25-12-16-27(42-4) )17-13-25/h5-17,20,28-30,32,38H,18-19,21H2,1-4H3,(H2,35,36,39)/t28-,29-,30-, 32-/m1/s1
InChI Ki
LYKTVJJXZQTNPK-PBAMLIMUSA-N
24 Isi Igoa mo lea mea
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2-methoxyethyl)-5-methylcytidine (ACI); 11: PN: US20030170636 ITULAU: 17 fai mai RNA; 12: PN: US20030211606 ITULAU: 18 fai mai R NA; 12: PN: US20030212017 ITULAU: 19 fai mai R NA; 14: PN: US20040005569 PAG E: 21 fai mai R NA; 15: PN: US20040005565 ITULAU: 17- 22 fai mai RNA; 15: PN: US20040005570 ITULAU: 19 fai mai R NA; 15: PN: U S20040006030 ITULAU: 22 fai mai R NA; 15: PN: US20040014048 ITULAU: 19 fai mai R NA; 16: PN: US20030171313 ITULAU: 9 fai mai RNA; 16: PN: US20030198965 ITULAU: 19 fai mai R NA; 16: PN: US20040014047 ITULAU: 19 fai mai R NA; 16: PN: US20040014049 ITULAU:

19 fai mai RNA; 17: PN: US20040014051 ITULAU: 21 fai mai R NA; 17: PN: US20040014699 ITULAU: 19 fai mai R NA; 17: PN: W
O03106645 ITULAU: 69 fai mai R NA; 18: PN: US20040006029 ITULAU: 22 fai mai R NA; 2'-O-Methoxyethyl-5'-O-dimethoxytrityl-5- methylcytidine; 58: PN: US20030166592 ITULAU: 15 fai mai R NA; 5: PN: WO2005006958 ITULAU: 61 fai mai R NA; 7: PN: WO20050 07825 ITULAU: 61 fai mai R NA; 82: PN: US20040171566 ITULAU: 18 fai mai R NA; 89: PN: US20040005707 ITULAU: 19 fai mai R NA; 9: PN: WO03084478 ITULAU: 56 fai mai R NA

Meatotino Va'ai

Meatotino avanoa
Biological
Kemisi
Malosi
Lipinski
Fauga Faatatau
Mafanafana

Biological

Meatotino Taua Tulaga Punavai
Bioconcentration Factor 1.56 pH 1; Maalili: 25 °C (1) ACD
Bioconcentration Factor 1.99 pH 2; Maalili: 25 °C (1) ACD
Bioconcentration Factor 6.19 pH 3; Maalili: 25 °C (1) ACD
Bioconcentration Factor 38.0 pH 4; Maalili: 25 °C (1) ACD
Bioconcentration Factor 116 pH 5; Maalili: 25 °C (1) ACD
Bioconcentration Factor 146 pH 6; Maalili: 25 °C (1) ACD
Bioconcentration Factor 150 pH 7; Maalili: 25 °C (1) ACD
Bioconcentration Factor 151 pH 8; Maalili: 25 °C (1) ACD
Bioconcentration Factor 151 pH 9; Maalili: 25 °C (1) ACD
Bioconcentration Factor 151 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 13.0 pH 1; Maalili: 25 °C (1) ACD
Koc 16.6 pH 2; Maalili: 25 °C (1) ACD
Koc 51.8 pH 3; Maalili: 25 °C (1) ACD
Koc 318 pH 4; Maalili: 25 °C (1) ACD
Koc 966 pH 5; Maalili: 25 °C (1) ACD
Koc 1220 pH 6; Maalili: 25 °C (1) ACD
Koc 1260 pH 7; Maalili: 25 °C (1) ACD

 

Meatotino Taua Tulaga Punavai
Koc 1260 pH 8; Maalili: 25 °C (1) ACD
Koc 1260 pH 9; Maalili: 25 °C (1) ACD
Koc 1260 pH 10; Maalili: 25 °C (1) ACD
ogalaauD 1.18 pH 1; Maalili: 25 °C (1) ACD
ogalaauD 1.29 pH 2; Maalili: 25 °C (1) ACD
ogalaauD 1.78 pH 3; Maalili: 25 °C (1) ACD
ogalaauD 2.57 pH 4; Maalili: 25 °C (1) ACD
ogalaauD 3.05 pH 5; Maalili: 25 °C (1) ACD
ogalaauD 3.16 pH 6; Maalili: 25 °C (1) ACD
ogalaauD 3.17 pH 7; Maalili: 25 °C (1) ACD
ogalaauD 3.17 pH 8; Maalili: 25 °C (1) ACD
ogalaauD 3.17 pH 9; Maalili: 25 °C (1) ACD
ogalaauD 3.17 pH 10; Maalili: 25 °C (1) ACD
logP 3.169±0.598 Maalili: 25 °C (1) ACD
Mass Intrinsic Solubility 5.2 x 10-3 g/L Maalili: 25 °C (1) ACD
Mass Solubility 0.51 g/L pH 1; Maalili: 25 °C (1) ACD
Mass Solubility 0.40 g/L pH 2; Maalili: 25 °C (1) ACD
Mass Solubility 0.13 g/L pH 3; Maalili: 25 °C (1) ACD
Mass Solubility 0.020 g/L pH 4; Maalili: 25 °C (1) ACD
Mass Solubility 6.8 x 10-3 g/L pH 5; Maalili: 25 °C (1) ACD
Mass Solubility 5.4 x 10-3 g/L pH 6; Maalili: 25 °C (1) ACD
Mass Solubility 5.3 x 10-3 g/L pH 7; Maalili: 25 °C (1) ACD
Mass Solubility 5.2 x 10-3 g/L pH 8; Maalili: 25 °C (1) ACD
Mass Solubility 5.2 x 10-3 g/L pH 9; Maalili: 25 °C (1) ACD
Mass Solubility 5.2 x 10-3 g/L pH 10; Maalili: 25 °C (1) ACD
Mass Solubility 5.3 x 10-3 g/L Suavai e le fa'afefe pH 7.05; Maalili: 25 °C (1) ACD
Molar Intrinsic Solubility 8.4 x 10-6 mol/L Maalili: 25 °C (1) ACD
Molar Solubility 8.2 x 10-4 mol/L pH 1; Maalili: 25 °C (1) ACD
Molar Solubility 6.4 x 10-4 mol/L pH 2; Maalili: 25 °C (1) ACD
Molar Solubility 2.1 x 10-4 mol/L pH 3; Maalili: 25 °C (1) ACD
Molar Solubility 3.3 x 10-5 mol/L pH 4; Maalili: 25 °C (1) ACD
Molar Solubility 1.1 x 10-5 mol/L pH 5; Maalili: 25 °C (1) ACD

 

Meatotino Taua Tulaga Punavai
Molar Solubility 8.7 x 10-6 mol/L pH 6; Maalili: 25 °C (1) ACD
Molar Solubility 8.5 x 10-6 mol/L pH 7; Maalili: 25 °C (1) ACD
Molar Solubility 8.4 x 10-6 mol/L pH 8; Maalili: 25 °C (1) ACD
Molar Solubility 8.4 x 10-6 mol/L pH 9; Maalili: 25 °C (1) ACD
Molar Solubility 8.4 x 10-6 mol/L pH 10; Maalili: 25 °C (1) ACD
Molar Solubility 8.5 x 10-6 mol/L Suavai e le fa'afefe pH 7.05; Maalili: 25 °C (1) ACD
Molecular Weight 617.69    
pKa 13.31±0.70 Le Tele o le Asi Sua: 25 °C (1) ACD
pKa 4.58±0.10 Tele Su'esu'ega Autu: 25 °C (1) ACD
Omiga ausa 1.89 x 10-24 Torr 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)

Malosi

Meatotino Taua Tulaga Punavai
Malosi 1.27±0.1 g/cm3 Maalili: 20 °C; Lomitusi: 760 Torr (1) ACD
Molar Volume 483.8±7.0 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 14   (1) ACD
H Tagata talia 11   (1) ACD
H Donors 3   (1) ACD
H Fa'ameaalofa/Tagata Talia 14   (1) ACD
logP 3.169±0.598 Maalili: 25 °C (1) ACD
Molecular Weight 617.69    

(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 134 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)

Mafanafana

Meatotino Taua Tulaga Punavai
Fa'apuna 762.6±70.0 °C Lomitusi: 760 Torr (1) ACD
Entalpy o le Ausa 116.53±3.0 kJ/mol Lomitusi: 760 Torr (1) ACD
Mata'imu 415.0±35.7 °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)

Va'aiga Spectra

Spectra avanoa
1H NMR
13C NMR


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