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

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

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Bayanin Abu

Lambar Rijistar CAS

168427-74-5

Mabuɗin Abubuwan Jiki Daraja Sharadi
Nauyin Kwayoyin Halitta 325.32 -
Wurin tafasa (An annabta) 639.0± 65.0 °C Latsa: 760 Torr
Girma (An annabta) 1.70± 0.1 g/cm3 Zazzabi: 20 ° C;Latsa: 760 Torr
pKa (An annabta) 13.12± 0.70 Mafi yawan zafin jiki: 25 ° C

Sauran Sunaye da Masu Ganewa

MURMUSHI na Canonical

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

MURMUSHI

O(CCOC)[C@H]1[C@@H](O[C@H](CO)[C@H]1O)N2C=3C(N=C2)=C(N)N=CN3

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

InChi Key

PUDXUJRJLRLJIU-QYVSTXNMSA-N

1 Wani Sunan Wannan Abu

2'-O(2-Methoxyethyl) adenosine (ACI)

Spectra akwai
1 H NMR
13 C NMR

Abubuwan Hasashen

Properties akwai
Halittu
Chemical
Yawan yawa
Lipinski
Tsarin Yanayi
Thermal

Halittu

Dukiya Daraja Sharadi Source
Factor na Bioconcentration 1.0 pH da 1;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 2;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 3;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 4;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.18 pH da 5;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.31 pH da 6;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.32 pH da 7;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.32 pH da 8;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.32 pH da 9;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.32 pH 10;Zazzabi: 25 ° C (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Chemical

Dukiya Daraja Sharadi Source
Koc 1.0 pH da 1;Zazzabi: 25 ° C (1) ACD
Koc 1.0 pH da 2;Zazzabi: 25 ° C (1) ACD
Koc 3.39 pH da 3;Zazzabi: 25 ° C (1) ACD
Koc 19.4 pH da 4;Zazzabi: 25 ° C (1) ACD
Koc 38.0 pH da 5;Zazzabi: 25 ° C (1) ACD
Koc 42.0 pH da 6;Zazzabi: 25 ° C (1) ACD
Koc 42.5 pH da 7;Zazzabi: 25 ° C (1) ACD

 

Dukiya Daraja Sharadi Source
Koc 42.5 pH da 8;Zazzabi: 25 ° C (1) ACD
Koc 42.5 pH da 9;Zazzabi: 25 ° C (1) ACD
Koc 42.5 pH 10;Zazzabi: 25 ° C (1) ACD
logD -1.94 pH da 1;Zazzabi: 25 ° C (1) ACD
logD -1.48 pH da 2;Zazzabi: 25 ° C (1) ACD
logD -0.64 pH da 3;Zazzabi: 25 ° C (1) ACD
logD 0.12 pH da 4;Zazzabi: 25 ° C (1) ACD
logD 0.41 pH da 5;Zazzabi: 25 ° C (1) ACD
logD 0.46 pH da 6;Zazzabi: 25 ° C (1) ACD
logD 0.46 pH da 7;Zazzabi: 25 ° C (1) ACD
logD 0.46 pH da 8;Zazzabi: 25 ° C (1) ACD
logD 0.46 pH da 9;Zazzabi: 25 ° C (1) ACD
logD 0.46 pH 10;Zazzabi: 25 ° C (1) ACD
logP 0.462± 0.647 Zazzabi: 25 ° C (1) ACD
Mass Intrinsic Solubility 4.2 g/l Zazzabi: 25 ° C (1) ACD
Mass Solubility 999 g/l pH da 1;Zazzabi: 25 ° C (1) ACD
Mass Solubility 381 g/l pH da 2;Zazzabi: 25 ° C (1) ACD
Mass Solubility 55 g/l pH da 3;Zazzabi: 25 ° C (1) ACD
Mass Solubility 9.4g/l pH da 4;Zazzabi: 25 ° C (1) ACD
Mass Solubility 4.9g/l pH da 5;Zazzabi: 25 ° C (1) ACD
Mass Solubility 4.2 g/l pH da 6;Zazzabi: 25 ° C (1) ACD
Mass Solubility 4.2 g/l pH da 7;Zazzabi: 25 ° C (1) ACD
Mass Solubility 4.2 g/l pH da 8;Zazzabi: 25 ° C (1) ACD
Mass Solubility 4.2 g/l pH da 9;Zazzabi: 25 ° C (1) ACD
Mass Solubility 4.2 g/l pH 10;Zazzabi: 25 ° C (1) ACD
Mass Solubility 4.2 g/l Ruwan da ba a buguwa pH 8.08;Zazzabi: 25 ° C (1) ACD
Solubility na Ciki na Molar 0.013 mol/L Zazzabi: 25 ° C (1) ACD
Solubility na Molar 3.07 mol/L pH da 1;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 1.17 mol/L pH da 2;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.17 mol/L pH da 3;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.029 mol/L pH da 4;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.015 mol/L pH da 5;Zazzabi: 25 ° C (1) ACD

 

Dukiya Daraja Sharadi Source
Solubility na Molar 0.013 mol/L pH da 6;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.013 mol/L pH da 7;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.013 mol/L pH da 8;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.013 mol/L pH da 9;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.013 mol/L pH 10;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.013 mol/L Ruwan da ba a buguwa pH 8.08;Zazzabi: 25 ° C (1) ACD
Nauyin Kwayoyin Halitta 325.32    
pKa 13.12± 0.70 Mafi yawan zafin jiki: 25 ° C (1) ACD
pKa 3.82± 0.10 Mafi Asalin Zazzabi: 25 ° C (1) ACD
Ruwan Ruwa 3.35 x 10-17 Torr Zazzabi: 25 ° C (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Yawan yawa

Dukiya Daraja Sharadi Source
Yawan yawa 1.70± 0.1 g/cm3 Zazzabi: 20 ° C;Latsa: 760 Torr (1) ACD
Ƙarar Molar 191.2± 7.0 cm3/mol Zazzabi: 20 ° C;Latsa: 760 Torr (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Dukiya Daraja Sharadi Source
Ƙimar Rarraba Kyauta 8   (1) ACD
H Masu karɓa 10   (1) ACD
H Masu Ba da taimako 4   (1) ACD
H Donor/Acceptor Sum 14   (1) ACD
logP 0.462± 0.647 Zazzabi: 25 ° C (1) ACD
Nauyin Kwayoyin Halitta 325.32    

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Tsarin Yanayi

Dukiya Daraja Tushen yanayi
Wuri Mai Girma 138 A2 (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Dukiya Daraja Sharadi Source
Wurin Tafasa 639.0± 65.0 °C Latsa: 760 Torr (1) ACD
Enthalpy na Vaporization 99.17± 3.0 kJ/mol Latsa: 760 Torr (1) ACD
Wurin Flash 340.2± 34.3 °C (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Spectra da aka annabta

Spectra akwai
1H NMR
13C NMR


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