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

Zambiri Zoyambira:

Titumizireni imelo

Tsatanetsatane wa Zamalonda

Zolemba Zamalonda

Tsatanetsatane wa Mankhwala

Nambala ya Registry ya CAS

473278-54-5

Zofunika Zathupi	Mtengo	Mkhalidwe
Kulemera kwa Maselo	341.32	-
Boiling Point (Zonenedweratu)	715.0±70.0 °C	Press: 760 Torr
Kachulukidwe (Zonenedweratu)	1.81±0.1 g/cm3	Kutentha: 20 ° C;Press: 760 Torr
pKa (Zonenedweratu)	13.20±0.70	Kutentha Kwambiri kwa Acid: 25 ° C

Mayina Ena ndi Zizindikiritso

Canonical SMILES

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

Isomeric AMAmwetulira

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 Dzina Lina la chinthu ichi

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

Katundu zilipo
Kuwala ndi Kubalalika
Kutentha

Optical ndi Scatering

Katundu	Mtengo	Mkhalidwe	Gwero
Mphamvu Yozungulira ya Optical	-51 deg-mL/g-dm	c: 1.4 g / 100ml;Zosungunulira: Dichloromethane;: 589.3 nm;Kutentha: 25 ° C	(1) CAS
Mphamvu Yozungulira ya Optical	Onani Mawu Onse		(2) CAS

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

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

Kutentha

Katundu	Mtengo	Condition Source
Melting Point	Onani Mawu Onse	(1) CAS

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

Experimental Spectra

Spectra ilipo
1H NMR
13 C NMR
IR

Zonenedweratu Katundu

Katundu zilipo
Zachilengedwe
Chemical
Kuchulukana
Lipinski
Zogwirizana ndi Kapangidwe
Kutentha

Zachilengedwe

Katundu	Mtengo	Mkhalidwe	Gwero
Bioconcentration Factor	1.0	pH 1;Kutentha: 25 ° C	(1) ACD
Bioconcentration Factor	1.0	pH 2;Kutentha: 25 ° C	(1) ACD
Bioconcentration Factor	1.0	pH 3;Kutentha: 25 ° C	(1) ACD
Bioconcentration Factor	1.0	pH 4;Kutentha: 25 ° C	(1) ACD

Katundu	Mtengo	Mkhalidwe	Gwero
Bioconcentration Factor	1.0	pH 5;Kutentha: 25 ° C	(1) ACD
Bioconcentration Factor	1.0	pH 6;Kutentha: 25 ° C	(1) ACD
Bioconcentration Factor	1.0	pH 7;Kutentha: 25 ° C	(1) ACD
Bioconcentration Factor	1.0	pH 8;Kutentha: 25 ° C	(1) ACD
Bioconcentration Factor	1.0	pH 9;Kutentha: 25 ° C	(1) ACD
Bioconcentration Factor	1.0	pH 10;Kutentha: 25 ° C	(1) ACD

Chemical

Katundu	Mtengo	Mkhalidwe	Gwero
Koc	1.0	pH 1;Kutentha: 25 ° C	(1) ACD
Koc	1.0	pH 2;Kutentha: 25 ° C	(1) ACD
Koc	4.27	pH 3;Kutentha: 25 ° C	(1) ACD
Koc	8.49	pH 4;Kutentha: 25 ° C	(1) ACD
Koc	9.43	pH 5;Kutentha: 25 ° C	(1) ACD
Koc	9.54	pH 6;Kutentha: 25 ° C	(1) ACD
Koc	9.55	pH 7;Kutentha: 25 ° C	(1) ACD
Koc	9.55	pH 8;Kutentha: 25 ° C	(1) ACD
Koc	9.55	pH 9;Kutentha: 25 ° C	(1) ACD
Koc	9.54	pH 10;Kutentha: 25 ° C	(1) ACD
logD	-2.65	pH 1;Kutentha: 25 ° C	(1) ACD
logD	-1.84	pH 2;Kutentha: 25 ° C	(1) ACD
logD	-1.08	pH 3;Kutentha: 25 ° C	(1) ACD
logD	-0.78	pH 4;Kutentha: 25 ° C	(1) ACD
logD	-0.74	pH 5;Kutentha: 25 ° C	(1) ACD
logD	-0.73	pH 6;Kutentha: 25 ° C	(1) ACD
logD	-0.73	pH 7;Kutentha: 25 ° C	(1) ACD
logD	-0.73	pH 8;Kutentha: 25 ° C	(1) ACD
logD	-0.73	pH 9;Kutentha: 25 ° C	(1) ACD
logD	-0.73	pH 10;Kutentha: 25 ° C	(1) ACD
logP	-0.730±0.568	Kutentha: 25 ° C	(1) ACD
Mass Intrinsic Solubility	0.44g/L	Kutentha: 25 ° C	(1) ACD
Misa Solubility	38g/l	pH 1;Kutentha: 25 ° C	(1) ACD
Misa Solubility	5.5g/L	pH 2;Kutentha: 25 ° C	(1) ACD

Katundu	Mtengo	Mkhalidwe	Gwero
Misa Solubility	0.96g/L	pH 3;Kutentha: 25 ° C	(1) ACD
Misa Solubility	0.48g/L	pH 4;Kutentha: 25 ° C	(1) ACD
Misa Solubility	0.44g/L	pH 5;Kutentha: 25 ° C	(1) ACD
Misa Solubility	0.44g/L	pH 6;Kutentha: 25 ° C	(1) ACD
Misa Solubility	0.44g/L	pH 7;Kutentha: 25 ° C	(1) ACD
Misa Solubility	0.44g/L	pH 8;Kutentha: 25 ° C	(1) ACD
Misa Solubility	0.44g/L	pH 9;Kutentha: 25 ° C	(1) ACD
Misa Solubility	0.44g/L	pH 10;Kutentha: 25 ° C	(1) ACD
Misa Solubility	0.44g/L	Madzi Osasunthika pH 7.20;Kutentha: 25 ° C	(1) ACD
Molar Intrinsic Solubility	1.3 x 10-3 mol / L	Kutentha: 25 ° C	(1) ACD
Molar Solubility	0.11 mol / L	pH 1;Kutentha: 25 ° C	(1) ACD
Molar Solubility	0.016 mol / L	pH 2;Kutentha: 25 ° C	(1) ACD
Molar Solubility	2.8 x 10-3 mol / L	pH 3;Kutentha: 25 ° C	(1) ACD
Molar Solubility	1.4 x 10-3 mol / L	pH 4;Kutentha: 25 ° C	(1) ACD
Molar Solubility	1.3 x 10-3 mol / L	pH 5;Kutentha: 25 ° C	(1) ACD
Molar Solubility	1.3 x 10-3 mol / L	pH 6;Kutentha: 25 ° C	(1) ACD
Molar Solubility	1.3 x 10-3 mol / L	pH 7;Kutentha: 25 ° C	(1) ACD
Molar Solubility	1.3 x 10-3 mol / L	pH 8;Kutentha: 25 ° C	(1) ACD
Molar Solubility	1.3 x 10-3 mol / L	pH 9;Kutentha: 25 ° C	(1) ACD
Molar Solubility	1.3 x 10-3 mol / L	pH 10;Kutentha: 25 ° C	(1) ACD
Molar Solubility	1.3 x 10-3 mol / L	Madzi Osasunthika pH 7.20;Kutentha: 25 ° C	(1) ACD
Kulemera kwa Maselo	341.32
pKa	13.20±0.70	Kutentha Kwambiri kwa Acid: 25 ° C	(1) ACD
pKa	3.00±0.20	Kutentha Kwambiri Kwambiri: 25 °C	(1) ACD
Kuthamanga kwa Vapor	1.86 x 10-21 torr	Kutentha: 25 ° C	(1) ACD

Kuchulukana

Katundu	Mtengo	Mkhalidwe	Gwero
Kuchulukana	1.81±0.1 g/cm3	Kutentha: 20 ° C;Press: 760 Torr	(1) ACD
Molar Volume	188.5±7.0cm3/mol	Kutentha: 20 ° C;Press: 760 Torr	(1) ACD

Lipinski

Katundu	Mtengo	Mkhalidwe	Gwero
Ma Bond Osinthasintha Mwaulere	8		(1) ACD
H Olandira	11		(1) ACD
H Opereka	5		(1) ACD
H Chiwerengero cha Wopereka / Wolandira	16		(1) ACD
logP	-0.730±0.568	Kutentha: 25 ° C	(1) ACD
Kulemera kwa Maselo	341.32

Zogwirizana ndi Kapangidwe

Katundu	Mtengo	Condition Source
Malo a Polar Surface	153 a2	(1) ACD

Kutentha

Katundu	Mtengo	Mkhalidwe	Gwero
Boiling Point	715.0±70.0 °C	Press: 760 Torr	(1) ACD
Enthalpy ya vaporization	109.72±3.0 kJ/mol	Press: 760 Torr	(1) ACD
Pophulikira	386.2±35.7 °C		(1) ACD