C13H19N5O6 Guanosin, 2′-O- (2-methoxyethyl)- (9CI, ACI)

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C13H19N5O6 Guanosin, 2′-O- (2-methoxyethyl)- (9CI, ACI)

Bayanan asali:


Cikakken Bayani

Tags samfurin

Bayanin Abu

Lambar Rijistar CAS

473278-54-5

Mabuɗin Abubuwan Jiki Daraja Sharadi
Nauyin Kwayoyin Halitta 341.32 -
Wurin tafasa (An annabta) 715.0±70.0 °C Latsa: 760 Torr
Girma (An annabta) 1.81± 0.1 g/cm3 Zazzabi: 20 ° C;Latsa: 760 Torr
pKa (An annabta) 13.20± 0.70 Mafi yawan zafin jiki: 25 ° C

Sauran Sunaye da Masu Ganewa

MURMUSHI na Canonical

O=C1N=C(N)NC2=C1N=CN2C3OC(CO)C(O)C3OCCOC

MURMUSHI

O(CCOC)[C@H]1[C@@H](O[C@H](CO)[C@H]1O)N2C3=C(N=C2)C(=O)N=C( N) N3

InChi

InChi= 1S/C13H19N5O6/c1-22-2-3-23-9-8(20)6(4-19)24-12(9)18-5-15-7-10(18)16-13( 14)17-11 (7)21/h5-6,8-9,12,19-20H,2-4H2,1H3,(H3, 14,16,17,21)/t6-,8-,9- ,12-/m1/s1

InChi Key

DLLBJSLIKOKFHE-WOUKDFQISA-N

1 Wani Sunan Wannan Abu

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

Properties akwai
Na gani da Watsawa
Thermal

Na gani da kuma Scatering

Dukiya Daraja Sharadi Source
Ƙarfin Juyawar gani -51-mL/g-dm c: 1.4 g/100ml;Mai narkewa: Dichloromethane;girman: 589.3 nm;Zazzabi: 25 ° C (1) CAS
Ƙarfin Juyawar gani Duba Cikakken Rubutu   (2) CAS

(1) Wen, Ke;Jaridar Organic Chemistry, (2002), 67 (22), 7887-7889, CAplus

(2) Wen, Ke;Jaridar Organic Chemistry, (2002), 67 (22), 7887-7889, CAplus

Thermal

Dukiya Daraja Tushen yanayi
Matsayin narkewa Duba Cikakken Rubutu (1) CAS

(1) Taj, Shabbir Ali S.;Nucleosides, Nucleotides & Nucleic Acids, (2008), 27 (9), 1024-1033, CAplus

Spectra na Gwaji

Spectra akwai
1 H NMR
13 C NMR
IR

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

 

Dukiya Daraja Sharadi Source
Factor na Bioconcentration 1.0 pH da 5;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 6;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 7;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 8;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 9;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 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 4.27 pH da 3;Zazzabi: 25 ° C (1) ACD
Koc 8.49 pH da 4;Zazzabi: 25 ° C (1) ACD
Koc 9.43 pH da 5;Zazzabi: 25 ° C (1) ACD
Koc 9.54 pH da 6;Zazzabi: 25 ° C (1) ACD
Koc 9.55 pH da 7;Zazzabi: 25 ° C (1) ACD
Koc 9.55 pH da 8;Zazzabi: 25 ° C (1) ACD
Koc 9.55 pH da 9;Zazzabi: 25 ° C (1) ACD
Koc 9.54 pH 10;Zazzabi: 25 ° C (1) ACD
logD -2.65 pH da 1;Zazzabi: 25 ° C (1) ACD
logD -1.84 pH da 2;Zazzabi: 25 ° C (1) ACD
logD -1.08 pH da 3;Zazzabi: 25 ° C (1) ACD
logD -0.78 pH da 4;Zazzabi: 25 ° C (1) ACD
logD -0.74 pH da 5;Zazzabi: 25 ° C (1) ACD
logD -0.73 pH da 6;Zazzabi: 25 ° C (1) ACD
logD -0.73 pH da 7;Zazzabi: 25 ° C (1) ACD
logD -0.73 pH da 8;Zazzabi: 25 ° C (1) ACD
logD -0.73 pH da 9;Zazzabi: 25 ° C (1) ACD
logD -0.73 pH 10;Zazzabi: 25 ° C (1) ACD
logP -0.730± 0.568 Zazzabi: 25 ° C (1) ACD
Mass Intrinsic Solubility 0.44 g/L Zazzabi: 25 ° C (1) ACD
Mass Solubility 38 g/l pH da 1;Zazzabi: 25 ° C (1) ACD
Mass Solubility 5.5 g/l pH da 2;Zazzabi: 25 ° C (1) ACD

 

Dukiya Daraja Sharadi Source
Mass Solubility 0.96 g/L pH da 3;Zazzabi: 25 ° C (1) ACD
Mass Solubility 0.48 g/L pH da 4;Zazzabi: 25 ° C (1) ACD
Mass Solubility 0.44 g/L pH da 5;Zazzabi: 25 ° C (1) ACD
Mass Solubility 0.44 g/L pH da 6;Zazzabi: 25 ° C (1) ACD
Mass Solubility 0.44 g/L pH da 7;Zazzabi: 25 ° C (1) ACD
Mass Solubility 0.44 g/L pH da 8;Zazzabi: 25 ° C (1) ACD
Mass Solubility 0.44 g/L pH da 9;Zazzabi: 25 ° C (1) ACD
Mass Solubility 0.44 g/L pH 10;Zazzabi: 25 ° C (1) ACD
Mass Solubility 0.44 g/L Ruwan da ba a buƙata ba pH 7.20;Zazzabi: 25 ° C (1) ACD
Solubility na Ciki na Molar 1.3 x 10-3 mol/L Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.11 mol/L pH da 1;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.016 mol/L pH da 2;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 2.8 x 10-3 mol/L pH da 3;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 1.4 x 10-3 mol/L pH da 4;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 1.3 x 10-3 mol/L pH da 5;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 1.3 x 10-3 mol/L pH da 6;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 1.3 x 10-3 mol/L pH da 7;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 1.3 x 10-3 mol/L pH da 8;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 1.3 x 10-3 mol/L pH da 9;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 1.3 x 10-3 mol/L pH 10;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 1.3 x 10-3 mol/L Ruwan da ba a buƙata ba pH 7.20;Zazzabi: 25 ° C (1) ACD
Nauyin Kwayoyin Halitta 341.32    
pKa 13.20± 0.70 Mafi yawan zafin jiki: 25 ° C (1) ACD
pKa 3.00± 0.20 Mafi Asalin Zazzabi: 25 ° C (1) ACD
Ruwan Ruwa 1.86 x 10-21 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 1.81± 0.1 g/cm3 Zazzabi: 20 ° C;Latsa: 760 Torr (1) ACD
Ƙarar Molar 188.5± 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 11   (1) ACD
H Masu Ba da taimako 5   (1) ACD
H Donor/Acceptor Sum 16   (1) ACD
logP -0.730± 0.568 Zazzabi: 25 ° C (1) ACD
Nauyin Kwayoyin Halitta 341.32    

(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 153 A2 (1) ACD

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

Thermal

Dukiya Daraja Sharadi Source
Wurin Tafasa 715.0±70.0 °C Latsa: 760 Torr (1) ACD
Enthalpy na Vaporization 109.72± 3.0 kJ/mol Latsa: 760 Torr (1) ACD
Wurin Flash 386.2± 35.7 °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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