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

samfur

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

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Cikakken Bayani

Tags samfurin

Bayanin Abu

Lambar Rijistar CAS

2140-79-6

Mabuɗin Abubuwan Jiki Daraja Sharadi
Nauyin Kwayoyin Halitta 281.27 -
Wurin narkewa (Gwaji) 204-206 ° C -
Wurin tafasa (An annabta) 623.8± 65.0 °C Latsa: 760 Torr
Girma (An annabta) 1.84± 0.1 g/cm3 Zazzabi: 20 ° C;Latsa: 760 Torr
pKa (An annabta) 13.13 ± 0.70 Mafi yawan zafin jiki: 25 ° C

Sauran Sunaye da Masu Ganewa

MURMUSHI na Canonical

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

MURMUSHI

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 Wasu Sunaye na wannan Abu

2'-OMethyladenosine (ACI);Cordysinin B

Abubuwan Gwaji

Properties akwai
Thermal

Dukiya Daraja Tushen yanayi
Matsayin narkewa 204-206 ° C (1) CAS

(1) Martinez-Montero, Saul;Jaridar Turai na Kimiyyar Halittu, (2009) (19), 3265-3271, S3265/1-S3265/23, CAplus

Spectra na Gwaji

Spectra akwai
1 H NMR
13 C NMR
IR
Mass

Abubuwan 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
Factor na Bioconcentration 1.78 pH da 5;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.97 pH da 6;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.99 pH da 7;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.99 pH da 8;Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.99 pH da 9;Zazzabi: 25 ° C (1) ACD

 

Tushen Halin Ƙimar Dukiya
Halin Halittar Halitta 1.99 pH 10;Zazzabi: 25 ° C (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

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

 

Dukiya Daraja Sharadi Source
Mass Solubility 3.7 g/l pH da 8;Zazzabi: 25 ° C (1) ACD
Mass Solubility 3.7 g/l pH da 9;Zazzabi: 25 ° C (1) ACD
Mass Solubility 3.7 g/l pH 10;Zazzabi: 25 ° C (1) ACD
Mass Solubility 3.7 g/l Ruwan da ba a buguwa pH 8.07;Zazzabi: 25 ° C (1) ACD
Solubility na Ciki na Molar 0.013 mol/L Zazzabi: 25 ° C (1) ACD
Solubility na Molar 3.15 mol/L pH da 1;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 1.10 mol/L pH da 2;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.16 mol/L pH da 3;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.028 mol/L pH da 4;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.014 mol/L pH da 5;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.013 mol/L pH da 6;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.013 mol/L pH da 7;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.013 mol/L pH da 8;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.013 mol/L pH da 9;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.013 mol/L pH 10;Zazzabi: 25 ° C (1) ACD
Solubility na Molar 0.013 mol/L Ruwan da ba a buguwa pH 8.07;Zazzabi: 25 ° C (1) ACD
Nauyin Kwayoyin Halitta 281.27    
pKa 13.13 ± 0.70 Mafi yawan zafin jiki: 25 ° C (1) ACD
pKa 3.82± 0.10 Mafi Asalin Zazzabi: 25 ° C (1) ACD
Ruwan Ruwa 2.02 x 10-16 Torr Zazzabi: 25 ° C (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Yawan yawa

Dukiya Daraja Sharadi Source
Yawan yawa 1.84± 0.1 g/cm3 Zazzabi: 20 ° C;Latsa: 760 Torr (1) ACD
Ƙarar Molar 152.5± 7.0 cm3/mol Zazzabi: 20 ° C;Latsa: 760 Torr (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Dukiya Daraja Tushen yanayi
Ƙimar Rarraba Kyauta 5 (1) ACD
H Masu karɓa 9 (1) ACD
H Masu Ba da taimako 4 (1) ACD

 

Dukiya Daraja Sharadi Source
H Donor/Acceptor Sum 13   (1) ACD
logP 0.697± 0.596 Zazzabi: 25 ° C (1) ACD
Nauyin Kwayoyin Halitta 281.27    

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Tsarin Yanayi

Dukiya Daraja Tushen yanayi
Wuri Mai Girma 129 A2 (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Thermal

Dukiya Daraja Sharadi Source
Wurin Tafasa 623.8± 65.0 °C Latsa: 760 Torr (1) ACD
Enthalpy na Vaporization 97.11 ± 3.0 kJ/mol Latsa: 760 Torr (1) ACD
Wurin Flash 331.0± 34.3 °C   (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Spectra da aka annabta

Spectra akwai
1 H NMR
13 C NMR

Bayanin Hazard na GHS

Lambar Bayanin Hazard Source
H303 Yana iya zama illa idan an hadiye shi Kwararre Cuted

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