C13H19N5O5 Adenosine, 2′ -O-(2-methoxyethyl)- (9CI, ACI)

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C13H19N5O5 Adenosine, 2′ -O-(2-methoxyethyl)- (9CI, ACI)

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Faahfaahinta Walaxda

Lambarka Diiwaanka CAS

168427-74-5

Qalabka Jidhka ee Furaha ah Qiimaha Xaalad
Miisaanka Molecular 325.32 -
Barta karkarinta (La saadaaliyay) 639.0± 65.0 °C Riix: 760 Torr
Cufnaanta (La saadaaliyay) 1.70±0.1 g/cm3 Heerkulka: 20 °C; Riix: 760 Torr
pKa (La saadaaliyay) 13.12± 0.70 Heerkulka ugu acidic badan: 25 °C

Magacyada iyo Aqoonsiyada Kale

Dhoola-cadaynta Canonical

OCC1OC(N2C= NC=3C(= NC= NC32)N)C(OCCOC)C1O

Dhoola-caddeyn

O(CCOC)[C@H]1[C@@H](O[C@H](CO)[C@H]1O

InChi

InChi= 1S/C13H19N5O5/c1-21-2-3-22-10-9(20)7(4-19)23-13(10)18-6-17-8-11(14)15-5- 16-12 (8)18/h5-7,9-10,13,19-20H,2-4H2,1H3, (H2,14,15,16)/t7-,9-,10-,13-/ m1/s1

Furaha InChi

PUDXUJRJLRLJIU-QYVSTXNMSA-N

1 Magaca kale ee walaxdan

2′-O(2-Methoxyethyl) adenosine (ACI)

Spectra waa la heli karaa
1 H NMR
13 C NMR

Guryaha la saadaaliyay

Guryaha la heli karo
Nafley
Kiimiko
Cufnaanta
Lipinski
Qaab-dhismeedka La Xiriira
kulaylka

Nafley

Hanti Qiimaha Xaalad Xigasho
Qodobka bioconcentration 1.0 pH 1; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1.0 pH 2; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1.0 pH 3; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1.0 pH 4; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1.18 pH 5; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1.31 pH 6; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1.32 pH 7; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1.32 pH 8; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1.32 pH 9; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1.32 pH 10; Heerkulka: 25 °C (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Kiimiko

Hanti Qiimaha Xaalad Xigasho
Koc 1.0 pH 1; Heerkulka: 25 °C (1) ACD
Koc 1.0 pH 2; Heerkulka: 25 °C (1) ACD
Koc 3.39 pH 3; Heerkulka: 25 °C (1) ACD
Koc 19.4 pH 4; Heerkulka: 25 °C (1) ACD
Koc 38.0 pH 5; Heerkulka: 25 °C (1) ACD
Koc 42.0 pH 6; Heerkulka: 25 °C (1) ACD
Koc 42.5 pH 7; Heerkulka: 25 °C (1) ACD

 

Hanti Qiimaha Xaalad Xigasho
Koc 42.5 pH 8; Heerkulka: 25 °C (1) ACD
Koc 42.5 pH 9; Heerkulka: 25 °C (1) ACD
Koc 42.5 pH 10; Heerkulka: 25 °C (1) ACD
logD -1.94 pH 1; Heerkulka: 25 °C (1) ACD
logD -1.48 pH 2; Heerkulka: 25 °C (1) ACD
logD -0.64 pH 3; Heerkulka: 25 °C (1) ACD
logD 0.12 pH 4; Heerkulka: 25 °C (1) ACD
logD 0.41 pH 5; Heerkulka: 25 °C (1) ACD
logD 0.46 pH 6; Heerkulka: 25 °C (1) ACD
logD 0.46 pH 7; Heerkulka: 25 °C (1) ACD
logD 0.46 pH 8; Heerkulka: 25 °C (1) ACD
logD 0.46 pH 9; Heerkulka: 25 °C (1) ACD
logD 0.46 pH 10; Heerkulka: 25 °C (1) ACD
logP 0.462± 0.647 Heerkulka: 25 °C (1) ACD
Solubility Mass Intrinsic 4.2 g/L Heerkulka: 25 °C (1) ACD
Xalka tirada badan 999 g/L pH 1; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 381 g/L pH 2; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 55 g/L pH 3; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 9.4 g/L pH 4; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 4.9 g/L pH 5; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 4.2 g/L pH 6; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 4.2 g/L pH 7; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 4.2 g/L pH 8; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 4.2 g/L pH 9; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 4.2 g/L pH 10; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 4.2 g/L Biyaha aan la daboolin pH 8.08; Heerkulka: 25 °C (1) ACD
Solubility Intrinsic Molar 0.013 mol/L Heerkulka: 25 °C (1) ACD
Solubility Molar 3.07 mol/L pH 1; Heerkulka: 25 °C (1) ACD
Solubility Molar 1.17 mol/L pH 2; Heerkulka: 25 °C (1) ACD
Solubility Molar 0.17 mol/L pH 3; Heerkulka: 25 °C (1) ACD
Solubility Molar 0.029 mol/L pH 4; Heerkulka: 25 °C (1) ACD
Solubility Molar 0.015 mol/L pH 5; Heerkulka: 25 °C (1) ACD

 

Hanti Qiimaha Xaalad Xigasho
Solubility Molar 0.013 mol/L pH 6; Heerkulka: 25 °C (1) ACD
Solubility Molar 0.013 mol/L pH 7; Heerkulka: 25 °C (1) ACD
Solubility Molar 0.013 mol/L pH 8; Heerkulka: 25 °C (1) ACD
Solubility Molar 0.013 mol/L pH 9; Heerkulka: 25 °C (1) ACD
Solubility Molar 0.013 mol/L pH 10; Heerkulka: 25 °C (1) ACD
Solubility Molar 0.013 mol/L Biyaha aan la daboolin pH 8.08; Heerkulka: 25 °C (1) ACD
Miisaanka Molecular 325.32    
pKa 13.12± 0.70 Heerkulka ugu acidic badan: 25 °C (1) ACD
pKa 3.82± 0.10 Heerkulka ugu badan ee aasaasiga ah: 25 °C (1) ACD
Cadaadis uumiga 3.35 x 10-17 Torr Heerkulka: 25 °C (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Cufnaanta

Hanti Qiimaha Xaalad Xigasho
Cufnaanta 1.70±0.1 g/cm3 Heerkulka: 20 °C; Riix: 760 Torr (1) ACD
Mugga Molar 191.2 ± 7.0 cm3 / mol Heerkulka: 20 °C; Riix: 760 Torr (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Hanti Qiimaha Xaalad Xigasho
Boondhigyo si xor ah loo wareejin karo 8   (1) ACD
H Aqbalayaasha 10   (1) ACD
H Deeq-bixiyayaasha 4   (1) ACD
Ku-deeqaha/Aqbalka Wadarta 14   (1) ACD
logP 0.462± 0.647 Heerkulka: 25 °C (1) ACD
Miisaanka Molecular 325.32    

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Qaab-dhismeedka La Xiriira

Hanti Qiimaha Isha Xaaladda
Aagga dusha sare ee Polar 138 A2 (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Hanti Qiimaha Xaalad Xigasho
Barta Karsan 639.0± 65.0 °C Riix: 760 Torr (1) ACD
Enthalpy of uumiga 99.17± 3.0 kJ/mol Riix: 760 Torr (1) ACD
Barta Fiishka 340.2± 34.3 °C (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Spectra la saadaaliyay

Spectra waa la heli karaa
1H NMR
13C NMR


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