C11H15N5O4 Adenosine, 2′ -O-methyl- (7CI, 8CI, 9CI, ACI)

mankhwala

C11H15N5O4 Adenosine, 2′ -O-methyl- (7CI, 8CI, 9CI, ACI)

Zambiri Zoyambira:


Tsatanetsatane wa Zamalonda

Zolemba Zamalonda

Tsatanetsatane wa Mankhwala

Nambala ya Registry ya CAS

2140-79-6

Zofunika Zathupi Mtengo Mkhalidwe
Kulemera kwa Maselo 281.27 -
Melting Point (Zoyeserera) 204-206 ° C -
Boiling Point (Zonenedweratu) 623.8±65.0 °C Press: 760 Torr
Kachulukidwe (Zonenedweratu) 1.84±0.1 g/cm3 Kutentha: 20 ° C;Press: 760 Torr
pKa (Zonenedweratu) 13.13±0.70 Kutentha Kwambiri kwa Acid: 25 ° C

Mayina Ena ndi Zizindikiritso

Canonical SMILES

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

Isomeric AMAmwetulira

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

InChi

InChI= 1S/C11H15N5O4/c1-19-8-7(18)5(2-17)20-11(8)16-4-15-6-9(12)13-3-14-10(6) 16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7- ,8-,11-/m1/s1

InChi Key

FPUGCISOLXNPPC-IOSLPCCCSA-N

2 Maina ena a chinthu ichi

2'-O- Methyladenosine (ACI);Cordysinin B

Zoyeserera

Katundu zilipo
Kutentha

Katundu Mtengo Condition Source
Melting Point 204-206 ° C (1) CAS

(1) Martinez-Montero, Saul;European Journal of Organic Chemistry, (2009) (19), 3265-3271, S3265/1-S3265/23, CAplus

Experimental Spectra

Spectra ilipo
1H NMR
13 C NMR
IR
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 1.78 pH 5;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 1.97 pH 6;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 1.99 pH 7;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 1.99 pH 8;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 1.99 pH 9;Kutentha: 25 ° C (1) ACD

 

Katundu Wamtengo Woyambira Gwero
Bioconcentration Factor 1.99 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 1.0 pH 1;Kutentha: 25 ° C (1) ACD
Koc 1.0 pH 2;Kutentha: 25 ° C (1) ACD
Koc 4.54 pH 3;Kutentha: 25 ° C (1) ACD
Koc 26.0 pH 4;Kutentha: 25 ° C (1) ACD
Koc 51.0 pH 5;Kutentha: 25 ° C (1) ACD
Koc 56.4 pH 6;Kutentha: 25 ° C (1) ACD
Koc 57.0 pH 7;Kutentha: 25 ° C (1) ACD
Koc 57.1 pH 8;Kutentha: 25 ° C (1) ACD
Koc 57.1 pH 9;Kutentha: 25 ° C (1) ACD
Koc 57.0 pH 10;Kutentha: 25 ° C (1) ACD
logD -1.70 pH 1;Kutentha: 25 ° C (1) ACD
logD -1.25 pH 2;Kutentha: 25 ° C (1) ACD
logD -0.40 pH 3;Kutentha: 25 ° C (1) ACD
logD 0.36 pH 4;Kutentha: 25 ° C (1) ACD
logD 0.65 pH 5;Kutentha: 25 ° C (1) ACD
logD 0.69 pH 6;Kutentha: 25 ° C (1) ACD
logD 0.70 pH 7;Kutentha: 25 ° C (1) ACD
logD 0.70 pH 8;Kutentha: 25 ° C (1) ACD
logD 0.70 pH 9;Kutentha: 25 ° C (1) ACD
logD 0.70 pH 10;Kutentha: 25 ° C (1) ACD
logP 0.697±0.596 Kutentha: 25 ° C (1) ACD
Mass Intrinsic Solubility 3.7g/l Kutentha: 25 ° C (1) ACD
Misa Solubility 886g/l pH 1;Kutentha: 25 ° C (1) ACD
Misa Solubility 309g/l pH 2;Kutentha: 25 ° C (1) ACD
Misa Solubility 45g/l pH 3;Kutentha: 25 ° C (1) ACD
Misa Solubility 7.9g/l pH 4;Kutentha: 25 ° C (1) ACD
Misa Solubility 3.9g/l pH 5;Kutentha: 25 ° C (1) ACD
Misa Solubility 3.7g/l pH 6;Kutentha: 25 ° C (1) ACD
Misa Solubility 3.7g/l pH 7;Kutentha: 25 ° C (1) ACD

 

Katundu Mtengo Mkhalidwe Gwero
Misa Solubility 3.7g/l pH 8;Kutentha: 25 ° C (1) ACD
Misa Solubility 3.7g/l pH 9;Kutentha: 25 ° C (1) ACD
Misa Solubility 3.7g/l pH 10;Kutentha: 25 ° C (1) ACD
Misa Solubility 3.7g/l Madzi Osasunthika pH 8.07;Kutentha: 25 ° C (1) ACD
Molar Intrinsic Solubility 0.013 mol / L Kutentha: 25 ° C (1) ACD
Molar Solubility 3.15 mol / L pH 1;Kutentha: 25 ° C (1) ACD
Molar Solubility 1.10 mol / L pH 2;Kutentha: 25 ° C (1) ACD
Molar Solubility 0.16 mol / L pH 3;Kutentha: 25 ° C (1) ACD
Molar Solubility 0.028 mol / L pH 4;Kutentha: 25 ° C (1) ACD
Molar Solubility 0.014 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 8.07;Kutentha: 25 ° C (1) ACD
Kulemera kwa Maselo 281.27    
pKa 13.13±0.70 Kutentha Kwambiri kwa Acid: 25 ° C (1) ACD
pKa 3.82±0.10 Kutentha Kwambiri Kwambiri: 25 °C (1) ACD
Kuthamanga kwa Vapor 2.02 x 10-16 Mtundu Kutentha: 25 ° C (1) ACD

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

Kuchulukana

Katundu Mtengo Mkhalidwe Gwero
Kuchulukana 1.84±0.1 g/cm3 Kutentha: 20 ° C;Press: 760 Torr (1) ACD
Molar Volume 152.5±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 Condition Source
Ma Bond Osinthasintha Mwaulere 5 (1) ACD
H Olandira 9 (1) ACD
H Opereka 4 (1) ACD

 

Katundu Mtengo Mkhalidwe Gwero
H Chiwerengero cha Wopereka / Wolandira 13   (1) ACD
logP 0.697±0.596 Kutentha: 25 ° C (1) ACD
Kulemera kwa Maselo 281.27    

(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 129 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 623.8±65.0 °C Press: 760 Torr (1) ACD
Enthalpy ya vaporization 97.11±3.0 kJ/mol Press: 760 Torr (1) ACD
Pophulikira 331.0±34.3 °C   (1) ACD

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

Zoneneratu za Spectra

Spectra ilipo
1H NMR
13 C NMR

Zowopsa za GHS

Kodi Chidziwitso Chowopsa Gwero
H303 Zitha kukhala zovulaza ngati zitamezedwa Katswiri Wosankhidwa

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