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

oloa

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

Fa'amatalaga Autu:


Fa'amatalaga Oloa

Faailoga o oloa

Auiliiliga Mea

Numera Resitala CAS

2140-79-6

Meatotino Faaletino Autu Taua Tulaga
Molecular Weight 281.27 -
Lisi Lisi (Fa'ata'ita'i) 204-206 °C -
Fa'apuna (Va'ai) 623.8±65.0 °C Lomitusi: 760 Torr
To'atele (Va'ai) 1.84±0.1 g/cm3 Maalili: 20 °C; Lomitusi: 760 Torr
pKa (vala'aina) 13.13±0.70 Le Tele o le Acid Temp: 25 °C

Isi Igoa ma Fa'ailoaga

ATA'ITA'I 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 Ki

FPUGCISOLXNPPC-IOSLPCCCSA-N

2 Isi Igoa mo lea Mea

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

Meatotino Fa'ata'ita'i

Meatotino avanoa
Mafanafana

Meatotino Taua Tulaga Punavai
Lisi Lisi 204-206 °C (1) CAS

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

Fa'ata'ita'iga Spectra

Spectra avanoa
1 H NMR
13 C NMR
IR
Misasa

Meatotino Va'ai

Meatotino avanoa
Fa'aolaola
Kemisi
Malosi
Lipinski
Fauga Faatatau
Mafanafana

Fa'aolaola

Meatotino Taua Tulaga Punavai
Bioconcentration Factor 1.0 pH 1; Maalili: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 2; Maalili: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 3; Maalili: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 4; Maalili: 25 °C (1) ACD
Bioconcentration Factor 1.78 pH 5; Maalili: 25 °C (1) ACD
Bioconcentration Factor 1.97 pH 6; Maalili: 25 °C (1) ACD
Bioconcentration Factor 1.99 pH 7; Maalili: 25 °C (1) ACD
Bioconcentration Factor 1.99 pH 8; Maalili: 25 °C (1) ACD
Bioconcentration Factor 1.99 pH 9; Maalili: 25 °C (1) ACD

 

Punaoa Tulaga Tau Meatotino
Bioconcentration Factor 1.99 pH 10; Maalili: 25 °C (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Kemisi

Meatotino Taua Tulaga Punavai
Koc 1.0 pH 1; Maalili: 25 °C (1) ACD
Koc 1.0 pH 2; Maalili: 25 °C (1) ACD
Koc 4.54 pH 3; Maalili: 25 °C (1) ACD
Koc 26.0 pH 4; Maalili: 25 °C (1) ACD
Koc 51.0 pH 5; Maalili: 25 °C (1) ACD
Koc 56.4 pH 6; Maalili: 25 °C (1) ACD
Koc 57.0 pH 7; Maalili: 25 °C (1) ACD
Koc 57.1 pH 8; Maalili: 25 °C (1) ACD
Koc 57.1 pH 9; Maalili: 25 °C (1) ACD
Koc 57.0 pH 10; Maalili: 25 °C (1) ACD
ogalaauD -1.70 pH 1; Maalili: 25 °C (1) ACD
ogalaauD -1.25 pH 2; Maalili: 25 °C (1) ACD
ogalaauD -0.40 pH 3; Maalili: 25 °C (1) ACD
ogalaauD 0.36 pH 4; Maalili: 25 °C (1) ACD
ogalaauD 0.65 pH 5; Maalili: 25 °C (1) ACD
ogalaauD 0.69 pH 6; Maalili: 25 °C (1) ACD
ogalaauD 0.70 pH 7; Maalili: 25 °C (1) ACD
ogalaauD 0.70 pH 8; Maalili: 25 °C (1) ACD
ogalaauD 0.70 pH 9; Maalili: 25 °C (1) ACD
ogalaauD 0.70 pH 10; Maalili: 25 °C (1) ACD
logP 0.697±0.596 Maalili: 25 °C (1) ACD
Mass Intrinsic Solubility 3.7 g/L Maalili: 25 °C (1) ACD
Mass Solubility 886 g/L pH 1; Maalili: 25 °C (1) ACD
Mass Solubility 309 g/L pH 2; Maalili: 25 °C (1) ACD
Mass Solubility 45 g/L pH 3; Maalili: 25 °C (1) ACD
Mass Solubility 7.9 g/L pH 4; Maalili: 25 °C (1) ACD
Mass Solubility 3.9 g/L pH 5; Maalili: 25 °C (1) ACD
Mass Solubility 3.7 g/L pH 6; Maalili: 25 °C (1) ACD
Mass Solubility 3.7 g/L pH 7; Maalili: 25 °C (1) ACD

 

Meatotino Taua Tulaga Punavai
Mass Solubility 3.7 g/L pH 8; Maalili: 25 °C (1) ACD
Mass Solubility 3.7 g/L pH 9; Maalili: 25 °C (1) ACD
Mass Solubility 3.7 g/L pH 10; Maalili: 25 °C (1) ACD
Mass Solubility 3.7 g/L Suavai e le fa'asaoina pH 8.07; Maalili: 25 °C (1) ACD
Molar Intrinsic Solubility 0.013 mol/L Maalili: 25 °C (1) ACD
Molar Solubility 3.15 mol/L pH 1; Maalili: 25 °C (1) ACD
Molar Solubility 1.10 mol/L pH 2; Maalili: 25 °C (1) ACD
Molar Solubility 0.16 mol/L pH 3; Maalili: 25 °C (1) ACD
Molar Solubility 0.028 mol/L pH 4; Maalili: 25 °C (1) ACD
Molar Solubility 0.014 mol/L pH 5; Maalili: 25 °C (1) ACD
Molar Solubility 0.013 mol/L pH 6; Maalili: 25 °C (1) ACD
Molar Solubility 0.013 mol/L pH 7; Maalili: 25 °C (1) ACD
Molar Solubility 0.013 mol/L pH 8; Maalili: 25 °C (1) ACD
Molar Solubility 0.013 mol/L pH 9; Maalili: 25 °C (1) ACD
Molar Solubility 0.013 mol/L pH 10; Maalili: 25 °C (1) ACD
Molar Solubility 0.013 mol/L Suavai e le fa'asaoina pH 8.07; Maalili: 25 °C (1) ACD
Molecular Weight 281.27    
pKa 13.13±0.70 Le Tele o le Acid Temp: 25 °C (1) ACD
pKa 3.82±0.10 Vave Autu: 25 °C (1) ACD
Omiga ausa 2.02 x 10-16 Torr Maalili: 25 °C (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Malosi

Meatotino Taua Tulaga Punavai
Malosi 1.84±0.1 g/cm3 Maalili: 20 °C; Lomitusi: 760 Torr (1) ACD
Molar Volume 152.5±7.0 cm3/mol Maalili: 20 °C; Lomitusi: 760 Torr (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Meatotino Taua Tulaga Punavai
Noanoaga e mafai ona fesuia'i saoloto 5 (1) ACD
H Tagata talia 9 (1) ACD
H Donors 4 (1) ACD

 

Meatotino Taua Tulaga Punavai
H Fa'ameaalofa/Tagata Talia 13   (1) ACD
logP 0.697±0.596 Maalili: 25 °C (1) ACD
Molecular Weight 281.27    

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Fauga Faatatau

Meatotino Taua Tulaga Punavai
Polar Surface Area 129 A2 (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Mafanafana

Meatotino Taua Tulaga Punavai
Fa'apuna 623.8±65.0 °C Lomitusi: 760 Torr (1) ACD
Entalpy o le Ausa 97.11±3.0 kJ/mol Lomitusi: 760 Torr (1) ACD
Mata'imu 331.0±34.3 °C   (1) ACD

(1) Fa'atatau i le fa'aaogaina o le Atina'eina o Kemisi Maualuga (ACD/Labs) Polokalama V11.02 (© 1994-2023 ACD/Labs)

Va'aiga Spectra

Spectra avanoa
1 H NMR
13 C NMR

Fa'amatalaga Mata'utia GHS

Code Fa'amatalaga o Tulaga Lamatia Punavai
H303 Atonu e afaina pe a foloina Fa'atonu Fa'apitoa

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