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

ibicuruzwa

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

Amakuru y'ibanze:


Ibicuruzwa birambuye

Ibicuruzwa

Ibisobanuro birambuye

Numero ya CAS

2140-79-6

Ibyingenzi Byumubiri Agaciro Imiterere
Uburemere bwa molekile 281.27 -
Gushonga Ingingo (Ubushakashatsi) 204-206 ° C. -
Ingingo yo guteka (Biteganijwe) 623.8 ± 65.0 ° C. Kanda: 760 Torr
Ubucucike (Biteganijwe) 1.84 ± 0.1 g / cm3 Ubushyuhe: 20 ° C;Kanda: 760 Torr
pKa (Byahanuwe) 13.13 ± 0.70 Ubushyuhe bwinshi bwa Acide: 25 ° C.

Andi mazina nibiranga

Urwenya rwa Canonical

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

Isomeric SMILES

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 Urufunguzo

FPUGCISOLXNPPC-IOSLPCCCSA-N

2 Andi mazina kuriyi ngingo

2 ′ -O-Methyladenosine (ACI);Cordysinin B.

Ibyiza Byubushakashatsi

Ibyiza birahari
Ubushyuhe

Umutungo Agaciro Inkomoko
Ingingo yo gushonga 204-206 ° C. (1) URUBANZA

(1) Martinez-Montero, Sawuli;Ikinyamakuru cyo mu Burayi cya Chimie Organic, (2009) (19), 3265-3271, S3265 / 1-S3265 / 23, CAplus

Ikigereranyo

Spectra irahari
1 H NMR
13 C NMR
IR
Misa

Ibintu Byateganijwe

Ibyiza birahari
Ibinyabuzima
Imiti
Ubucucike
Lipinski
Imiterere ijyanye
Ubushyuhe

Ibinyabuzima

Umutungo Agaciro Imiterere Inkomoko
Ikintu cya Bioconcentration 1.0 pH 1;Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 2;Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 3;Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.0 pH 4;Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.78 pH 5;Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.97 pH 6;Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.99 pH 7;Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.99 pH 8;Ubushyuhe: 25 ° C. (1) ACD
Ikintu cya Bioconcentration 1.99 pH 9;Ubushyuhe: 25 ° C. (1) ACD

 

Agaciro Agaciro Imiterere Inkomoko
Ikintu cya Bioconcentration 1.99 pH 10;Ubushyuhe: 25 ° C (1) ACD

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Imiti

Umutungo Agaciro Imiterere Inkomoko
Koc 1.0 pH 1;Ubushyuhe: 25 ° C. (1) ACD
Koc 1.0 pH 2;Ubushyuhe: 25 ° C. (1) ACD
Koc 4.54 pH 3;Ubushyuhe: 25 ° C. (1) ACD
Koc 26.0 pH 4;Ubushyuhe: 25 ° C. (1) ACD
Koc 51.0 pH 5;Ubushyuhe: 25 ° C. (1) ACD
Koc 56.4 pH 6;Ubushyuhe: 25 ° C. (1) ACD
Koc 57.0 pH 7;Ubushyuhe: 25 ° C. (1) ACD
Koc 57.1 pH 8;Ubushyuhe: 25 ° C. (1) ACD
Koc 57.1 pH 9;Ubushyuhe: 25 ° C. (1) ACD
Koc 57.0 pH 10;Ubushyuhe: 25 ° C. (1) ACD
logD -1.70 pH 1;Ubushyuhe: 25 ° C. (1) ACD
logD -1.25 pH 2;Ubushyuhe: 25 ° C. (1) ACD
logD -0.40 pH 3;Ubushyuhe: 25 ° C. (1) ACD
logD 0.36 pH 4;Ubushyuhe: 25 ° C. (1) ACD
logD 0.65 pH 5;Ubushyuhe: 25 ° C. (1) ACD
logD 0.69 pH 6;Ubushyuhe: 25 ° C. (1) ACD
logD 0.70 pH 7;Ubushyuhe: 25 ° C. (1) ACD
logD 0.70 pH 8;Ubushyuhe: 25 ° C. (1) ACD
logD 0.70 pH 9;Ubushyuhe: 25 ° C. (1) ACD
logD 0.70 pH 10;Ubushyuhe: 25 ° C. (1) ACD
logP 0.697 ± 0.596 Ubushyuhe: 25 ° C. (1) ACD
Mass Massins Solubility 3.7 g / L. Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 886 g / L. pH 1;Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 309 g / L. pH 2;Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 45 g / L. pH 3;Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 7.9 g / L. pH 4;Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 3.9 g / L. pH 5;Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 3.7 g / L. pH 6;Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 3.7 g / L. pH 7;Ubushyuhe: 25 ° C. (1) ACD

 

Umutungo Agaciro Imiterere Inkomoko
Gukemura ibibazo 3.7 g / L. pH 8;Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 3.7 g / L. pH 9;Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 3.7 g / L. pH 10;Ubushyuhe: 25 ° C. (1) ACD
Gukemura ibibazo 3.7 g / L. Amazi adafite ingufu pH 8.07;Ubushyuhe: 25 ° C. (1) ACD
Molar Intrinsic Solubility 0.013 mol / L. Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 3.15 mol / L. pH 1;Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 1.10 mol / L. pH 2;Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0.16 mol / L. pH 3;Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0.028 mol / L. pH 4;Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0.014 mol / L. pH 5;Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0.013 mol / L. pH 6;Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0.013 mol / L. pH 7;Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0.013 mol / L. pH 8;Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0.013 mol / L. pH 9;Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0.013 mol / L. pH 10;Ubushyuhe: 25 ° C. (1) ACD
Amashanyarazi 0.013 mol / L. Amazi adafite ingufu pH 8.07;Ubushyuhe: 25 ° C. (1) ACD
Uburemere bwa molekile 281.27    
pKa 13.13 ± 0.70 Ubushyuhe bwinshi bwa Acide: 25 ° C. (1) ACD
pKa 3.82 ± 0.10 Ubushyuhe bwibanze: 25 ° C. (1) ACD
Umuvuduko w'umwuka 2.02 x 10-16 Torr Ubushyuhe: 25 ° C. (1) ACD

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Ubucucike

Umutungo Agaciro Imiterere Inkomoko
Ubucucike 1.84 ± 0.1 g / cm3 Ubushyuhe: 20 ° C;Kanda: 760 Torr (1) ACD
Umubumbe wa Molar 152.5 ± 7.0 cm3 / mol Ubushyuhe: 20 ° C;Kanda: 760 Torr (1) ACD

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Lipinski

Umutungo Agaciro Inkomoko
Impapuro zishobora guhinduka 5 (1) ACD
H Abakira 9 (1) ACD
H Abaterankunga 4 (1) ACD

 

Umutungo Agaciro Imiterere Inkomoko
H Abaterankunga / Abemera Sum 13   (1) ACD
logP 0.697 ± 0.596 Ubushyuhe: 25 ° C. (1) ACD
Uburemere bwa molekile 281.27    

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Imiterere ijyanye

Umutungo Agaciro Inkomoko
Ubuso bwa polarike 129 A2 (1) ACD

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Ubushyuhe

Umutungo Agaciro Imiterere Inkomoko
Ingingo 623.8 ± 65.0 ° C. Kanda: 760 Torr (1) ACD
Umwuka wo guhumeka 97.11 ± 3.0 kJ / mol Kanda: 760 Torr (1) ACD
Flash point 331.0 ± 34.3 ° C.   (1) ACD

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Ibiteganijwe

Spectra irahari
1 H NMR
13 C NMR

GHS Ibyatangajwe

Kode Amagambo ya Hazard Inkomoko
H303 Birashobora kuba bibi iyo umizwe Impuguke Yatunganijwe

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