C10H12N2O5 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-6-imodzi, 2,3,3a,9a-tetrah ydro-3-hydroxy-2-(hydroxymethyl)- 7-methyl-, (2R,3 R,3aS,9aR)- (9CI, ACI)

mankhwala

C10H12N2O5 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-6-imodzi, 2,3,3a,9a-tetrah ydro-3-hydroxy-2-(hydroxymethyl)- 7-methyl-, (2R,3 R,3aS,9aR)- (9CI, ACI)

Zambiri Zoyambira:


Tsatanetsatane wa Zamalonda

Zolemba Zamalonda

Tsatanetsatane wa Mankhwala

Nambala ya Registry ya CAS

22423-26-3

Zofunika Zathupi Mtengo Mkhalidwe
Kulemera kwa Maselo 240.21 -
Melting Point (Zoyeserera) 218 ° C Zosungunulira: Ethanol; Isopropanol
Boiling Point (Zonenedweratu) 452.0±55.0 °C Press: 760 Torr
Kachulukidwe (Zonenedweratu) 1.88±0.1 g/cm3 Kutentha: 20 ° C; Press: 760 Torr
pKa (Zonenedweratu) 12.56±0.60 Kutentha Kwambiri kwa Acid: 25 ° C

Mayina Ena ndi Zizindikiritso

Canonical SMILES

O=C1N=C2OC3C(O)C(OC3N2C=C1C)CO

Isomeric AMAmwetulira

O[C@H]1[C@]2([C@](N3C(O2)= NC(=O)C(C)=C3)(O[C@@H]1CO)[H])[ H]

InChi

InChI= 1S/C10H12N2O5/c1-4-2-12-9-7(6(14)5(3-13)16-9)17-10(12)11-8(4)15/h2,5- 7,9,13-14H,3H2,1H3/t5-,6-,7+,9-/m1/s1

InChi Key

WLLOAUCNUMYOQI-JAGXHNFQSA-N

17 Maina ena a chinthu ichi

(2R,3 R,3a ndiS,9a ndiR) -2,3,3a,9a-Tetrahydro-3-hydroxy-2-(hydroxymethyl)-7-methyl-6H-furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-6-imodzi (ACI);

6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-6-one, 2,3,3a,9a-tetrahydro-3-hydroxy-2-(hydroxymethyl)-7-methyl- (6CI, 7CI, 8CI); 6H-Furo

[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-6-one, 2,3,3a,9a-tetrahydro-3-hydroxy-2-(hydroxymethyl)-7-methyl-, [2]R-(2α,3β,3aβ,9aβ)]- (ZCI);

11: PN: US20040014699 TSAMBA: 18 amati DNA; 12: PN: US20040005565 TSAMBA: 17- 22 amati DNA; 12: PN: US20040005570 TSAMBA: 18 amati DNA; 12: PN: US20040006029 TSAMBA: 21 amati DNA; 12: PN: US20040014051 TSAMBA: 21 amati DNA; 1: PN: WO20050 06958 TSAMBA: 59 amati DNA; 2,2' -Anhydro (1- β -D-arabinofuranosyl) - 5-methyluracil; 3: PN: WO2005007825 TSAMBA: 59 amati DNA; 84: PN: US20040005707 TSAMBA: 18 amati DNA; 9: PN: US20040014048 TSAMBA: 19 amati DNA; 9: PN: US20040014049 TSAMBA: 19

akuti DNA;O2,2'-Anhydro-5-methyluridine; O2,2' -Anhydro-5-methyluridine; Mtengo wa 112690

Zoyeserera

Katundu zilipo
Kutentha

Kutentha

Katundu Mtengo Mkhalidwe Gwero
Melting Point 240-242 ° C (1) CAS
Melting Point 218 ° C Zosungunulira: Ethanol; Isopropanol (2) CAS
Melting Point Onani Mawu Onse (3) CAS
Melting Point Onani Mawu Onse (4) CAS

(1) Oliveira, Maralise P.; Journal of the Brazilian Chemical Society, (2015), 26(4), 816-821, CAPlus

(2) Takatsuki, Ken-ichi; Nucleosides, Nucleotides & Nucleic Acids, (2006), 25 (7), 719-734, CAplus

(3) Manoharan, Muthiah; US20030088079, A1, 2003, CAPlus

(4) Miraglia, Loren J.; WO2003048315, A2, 2003, CAPlus

Experimental Spectra

Spectra ilipo
1H NMR
13 C NMR
Hetero NMR
Misa

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
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

(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Chemical

Katundu Mtengo Mkhalidwe Gwero
Koc 12.9 pH 1; Kutentha: 25 ° C (1) ACD
Koc 12.9 pH 2; Kutentha: 25 ° C (1) ACD
Koc 12.9 pH 3; Kutentha: 25 ° C (1) ACD
Koc 12.9 pH 4; Kutentha: 25 ° C (1) ACD
Koc 12.9 pH 5; Kutentha: 25 ° C (1) ACD
Koc 12.9 pH 6; Kutentha: 25 ° C (1) ACD
Koc 12.9 pH 7; Kutentha: 25 ° C (1) ACD
Koc 12.9 pH 8; Kutentha: 25 ° C (1) ACD
Koc 12.9 pH 9; Kutentha: 25 ° C (1) ACD
Koc 12.9 pH 10; Kutentha: 25 ° C (1) ACD
logD -0.49 pH 1; Kutentha: 25 ° C (1) ACD
logD -0.49 pH 2; Kutentha: 25 ° C (1) ACD
logD -0.49 pH 3; Kutentha: 25 ° C (1) ACD
logD -0.49 pH 4; Kutentha: 25 ° C (1) ACD
logD -0.49 pH 5; Kutentha: 25 ° C (1) ACD
logD -0.49 pH 6; Kutentha: 25 ° C (1) ACD
logD -0.49 pH 7; Kutentha: 25 ° C (1) ACD
logD -0.49 pH 8; Kutentha: 25 ° C (1) ACD
logD -0.49 pH 9; Kutentha: 25 ° C (1) ACD
logD -0.49 pH 10; Kutentha: 25 ° C (1) ACD

 

Katundu Mtengo Mkhalidwe Gwero
logP -0.491±0.556 Kutentha: 25 ° C (1) ACD
Mass Intrinsic Solubility 3.1g/L Kutentha: 25 ° C (1) ACD
Misa Solubility 3.1g/L pH 1; Kutentha: 25 ° C (1) ACD
Misa Solubility 3.1g/L pH 2; Kutentha: 25 ° C (1) ACD
Misa Solubility 3.1g/L pH 3; Kutentha: 25 ° C (1) ACD
Misa Solubility 3.1g/L pH 4; Kutentha: 25 ° C (1) ACD
Misa Solubility 3.1g/L pH 5; Kutentha: 25 ° C (1) ACD
Misa Solubility 3.1g/L pH 6; Kutentha: 25 ° C (1) ACD
Misa Solubility 3.1g/L pH 7; Kutentha: 25 ° C (1) ACD
Misa Solubility 3.1g/L pH 8; Kutentha: 25 ° C (1) ACD
Misa Solubility 3.1g/L pH 9; Kutentha: 25 ° C (1) ACD
Misa Solubility 3.1g/L pH 10; Kutentha: 25 ° C (1) ACD
Misa Solubility 3.1g/L Madzi Osasunthika pH 6.94; Kutentha: 25 ° C (1) ACD
Molar Intrinsic Solubility 0.013 mol / L Kutentha: 25 ° C (1) ACD
Molar Solubility 0.013 mol / L pH 1; Kutentha: 25 ° C (1) ACD
Molar Solubility 0.013 mol / L pH 2; Kutentha: 25 ° C (1) ACD
Molar Solubility 0.013 mol / L pH 3; Kutentha: 25 ° C (1) ACD
Molar Solubility 0.013 mol / L pH 4; Kutentha: 25 ° C (1) ACD
Molar Solubility 0.013 mol / L pH 5; Kutentha: 25 ° C (1) ACD
Molar Solubility 0.013 mol / L pH 6; Kutentha: 25 ° C (1) ACD
Molar Solubility 0.013 mol / L pH 7; Kutentha: 25 ° C (1) ACD
Molar Solubility 0.013 mol / L pH 8; Kutentha: 25 ° C (1) ACD
Molar Solubility 0.013 mol / L pH 9; Kutentha: 25 ° C (1) ACD
Molar Solubility 0.013 mol / L pH 10; Kutentha: 25 ° C (1) ACD
Molar Solubility 0.013 mol / L Madzi Osasunthika pH 6.94; Kutentha: 25 ° C (1) ACD
Kulemera kwa Maselo 240.21    
pKa 12.56±0.60 Kutentha Kwambiri kwa Acid: 25 ° C (1) ACD
pKa -4.36±0.60 Kutentha Kwambiri Kwambiri: 25 °C (1) ACD
Kuthamanga kwa Vapor 4.54 x 10-10 Kutentha: 25 ° C (1) ACD

(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Katundu Mtengo Mkhalidwe Gwero
Kuchulukana 1.88±0.1 g/cm3 Kutentha: 20 ° C; Press: 760 Torr (1) ACD
Molar Volume 127.5±7.0cm3/mol Kutentha: 20 ° C; Press: 760 Torr (1) ACD

(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Katundu Mtengo Mkhalidwe Gwero
Ma Bond Osinthasintha Mwaulere 3   (1) ACD
H Olandira 7   (1) ACD
H Opereka 2   (1) ACD
H Chiwerengero cha Wopereka / Wolandira 9   (1) ACD
logP -0.491±0.556 Kutentha: 25 ° C (1) ACD
Kulemera kwa Maselo 240.21    

(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Zogwirizana ndi Kapangidwe

Katundu Mtengo Condition Source
Malo a Polar Surface 91.6 A2 (1) ACD

(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Kutentha

Katundu Mtengo Mkhalidwe Gwero
Boiling Point 452.0±55.0 °C Press: 760 Torr (1) ACD
Enthalpy ya vaporization 82.04±6.0 kJ/mol Press: 760 Torr (1) ACD
Pophulikira 227.2±31.5 °C   (1) ACD

(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Zoneneratu za Spectra

Spectra ilipo ⁿ
1H NMR
13 C NMR


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