C13H19N5O6 Guanosine, 2′-O- (2-methoxyethyl)- (9CI, ACI) Hoton da aka Fitar

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

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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

Kayayyakin 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

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

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

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

Tsarin Yanayi

Dukiya	Daraja	Tushen yanayi
Wuri Mai Girma	153 A2	(1) ACD

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