C11H15N5O5 Guanosine, 2′ -O-methyl- (7CI, 8CI, 9CI, ACI)

chigadzirwa

C11H15N5O5 Guanosine, 2′ -O-methyl- (7CI, 8CI, 9CI, ACI)

Basic Information:


Product Detail

Product Tags

Details Detail

CAS Registry Nhamba

2140-71-8

Zvinhu Zvinokosha Zvemuviri Value Condition
Molecular Weight 297.27 -
Melting Point (Yekuedza) 233-235 °C Solvent: Methanol
Density (zvakafanotaurwa) 1.98±0.1 g/cm3 Tembiricha: 20 °C;Dhinda: 760 Torr
pKa (Zvakafanotaurwa) 9.64±0.20 Yakanyanya Acid Temp: 25 °C

Mamwe Mazita Nezviziviso

Canonical SMILES

O=C1N=C(N)NC2=C1N=CN2C3OC(CO)C(O)C3OC

Isomeric SMILES

O(C)[C@H]1[C@H](N2C3=C(N=C2)C(=O)N=C(N)N3)O[C@H](CO)[C@H ]1O

InChi

InChI= 1S/C11H15N5O5/c1-20-7-6(18)4(2-17)21-10(7)16-3-13-5-8(16)14-11(12)15-9( 5)19/h3-4,6-7,10,17-18H,2H2,1H3,(H3,12,14,15,19) /t4-,6-,7-,10-/m1/s1

InChi Key

OVYNGSFVYRPRCG-KQYNXXCUSA-N

1 Rimwe Zita reChinhu ichi

2'-O-Methylguanosine (ACI)

Properties iripo
Chemical
Thermal

Chemical

Property Value Condition Source
pKa 9.5 (1) CAS

(1) Bhamra, Inder;Nucleic Acids Research,

Thermal

Property Value Condition Source
Melting Point 233-235 °C Solvent: Methanol (1) CAS

(1) Kore, Anilkumar R.;Nucleosides, Nucleotides uye Nucleic Acids,

Experimental Spectra

Spectra iripo
1 H NMR
13 C NMR
Misa

Predicted Properties

Properties iripo
Biological
Chemical
Density
Lipinski
Chimiro Chinoenderana

Biological

Property Value Condition Source
Bioconcentration Factor 1.0 pH 1;Tembiricha: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 2;Tembiricha: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 3;Tembiricha: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 4;Tembiricha: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 5;Tembiricha: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 6;Tembiricha: 25 °C (1) ACD

 

Property Value Condition Source
Bioconcentration Factor 1.0 pH 7;Tembiricha: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 8;Tembiricha: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 9;Tembiricha: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 10;Tembiricha: 25 °C (1) ACD

(1) Yakaverengwa uchishandisa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Chemical

Property Value Condition Source
Koc 1.0 pH 1;Tembiricha: 25 °C (1) ACD
Koc 1.19 pH 2;Tembiricha: 25 °C (1) ACD
Koc 3.42 pH 3;Tembiricha: 25 °C (1) ACD
Koc 4.23 pH 4;Tembiricha: 25 °C (1) ACD
Koc 4.33 pH 5;Tembiricha: 25 °C (1) ACD
Koc 4.34 pH 6;Tembiricha: 25 °C (1) ACD
Koc 4.33 pH 7;Tembiricha: 25 °C (1) ACD
Koc 4.24 pH 8;Tembiricha: 25 °C (1) ACD
Koc 3.48 pH 9;Tembiricha: 25 °C (1) ACD
Koc 1.28 pH 10;Tembiricha: 25 °C (1) ACD
logD -2.76 pH 1;Tembiricha: 25 °C (1) ACD
logD -1.92 pH 2;Tembiricha: 25 °C (1) ACD
logD -1.46 pH 3;Tembiricha: 25 °C (1) ACD
logD -1.37 pH 4;Tembiricha: 25 °C (1) ACD
logD -1.36 pH 5;Tembiricha: 25 °C (1) ACD
logD -1.36 pH 6;Tembiricha: 25 °C (1) ACD
logD -1.36 pH 7;Tembiricha: 25 °C (1) ACD
logD -1.37 pH 8;Tembiricha: 25 °C (1) ACD
logD -1.45 pH 9;Tembiricha: 25 °C (1) ACD
logD -1.89 pH 10;Tembiricha: 25 °C (1) ACD
logP -1.359±0.544 Tembiricha: 25 °C (1) ACD
Mass Intrinsic Solubility 1.1 g/L Tembiricha: 25 °C (1) ACD
Mass Solubility 27 g/L pH 1;Tembiricha: 25 °C (1) ACD
Mass Solubility 3.9 g/L pH 2;Tembiricha: 25 °C (1) ACD
Mass Solubility 1.4 g/L pH 3;Tembiricha: 25 °C (1) ACD
Mass Solubility 1.1 g/L pH 4;Tembiricha: 25 °C (1) ACD

 

Property Value Condition Source
Mass Solubility 1.1 g/L pH 5;Tembiricha: 25 °C (1) ACD
Mass Solubility 1.1 g/L pH 6;Tembiricha: 25 °C (1) ACD
Mass Solubility 1.1 g/L pH 7;Tembiricha: 25 °C (1) ACD
Mass Solubility 1.1 g/L pH 8;Tembiricha: 25 °C (1) ACD
Mass Solubility 1.3 g/L pH 9;Tembiricha: 25 °C (1) ACD
Mass Solubility 3.6 g/L pH 10;Tembiricha: 25 °C (1) ACD
Mass Solubility 1.1 g/L Unbuffered Mvura pH 6.17;Tembiricha: 25 °C (1) ACD
Molar Intrinsic Solubility 3.6 x 10-3 mol/L Tembiricha: 25 °C (1) ACD
Molar Solubility 0.091 mol/L pH 1;Tembiricha: 25 °C (1) ACD
Molar Solubility 0.013 mol/L pH 2;Tembiricha: 25 °C (1) ACD
Molar Solubility 4.6 x 10-3 mol/L pH 3;Tembiricha: 25 °C (1) ACD
Molar Solubility 3.7 x 10-3 mol/L pH 4;Tembiricha: 25 °C (1) ACD
Molar Solubility 3.7 x 10-3 mol/L pH 5;Tembiricha: 25 °C (1) ACD
Molar Solubility 3.6 x 10-3 mol/L pH 6;Tembiricha: 25 °C (1) ACD
Molar Solubility 3.7 x 10-3 mol/L pH 7;Tembiricha: 25 °C (1) ACD
Molar Solubility 3.7 x 10-3 mol/L pH 8;Tembiricha: 25 °C (1) ACD
Molar Solubility 4.5 x 10-3 mol/L pH 9;Tembiricha: 25 °C (1) ACD
Molar Solubility 0.012 mol/L pH 10;Tembiricha: 25 °C (1) ACD
Molar Solubility 3.6 x 10-3 mol/L Unbuffered Mvura pH 6.17;Tembiricha: 25 °C (1) ACD
Molecular Weight 297.27    
pKa 9.64±0.20 Yakanyanya Acid Temp: 25 °C (1) ACD
pKa 2.42±0.10 Yakanyanya Basic Temp: 25 °C (1) ACD

(1) Yakaverengwa uchishandisa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Density

Property Value Condition Source
Density 1.98±0.1 g/cm3 Tembiricha: 20 °C;Dhinda: 760 Torr (1) ACD
Molar Volume 149.8±7.0 cm3/mol Tembiricha: 20 °C;Dhinda: 760 Torr (1) ACD

(1) Yakaverengwa uchishandisa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Property Value Condition Source
Zvakasununguka Zvisungo Zvinotenderera 5 (1) ACD

 

Property Value Condition Source
H Vagamuchiri 10   (1) ACD
H Vanopa 5   (1) ACD
H Donor/Acceptor Sum 15   (1) ACD
logP -1.359±0.544 Tembiricha: 25 °C (1) ACD
Molecular Weight 297.27    

(1) Yakaverengwa uchishandisa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Chimiro Chinoenderana

Property Value Condition Source
Nzvimbo yePolar Surface 144 A2 (1) ACD

(1) Yakaverengwa uchishandisa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Predicted Spectra

Spectra iripo
1 H NMR
13 C NMR


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