C11H15N5O4 Adenosine, 2′ -O-methyl- (7CI, 8CI, 9CI, ACI)
Inombolo yoBhaliso yeCAS
2140-79-6
| IiPropati zoMzimba eziPhambili | Ixabiso | Imeko |
| Ubunzima beMolekyuli | 281.27 | - |
| Indawo yokunyibilika (yoMfuniselo) | 204-206 °C | - |
| Indawo yokuBila (Kuqikelelwe) | 623.8±65.0 °C | Cinezela: 760 Torr |
| Ukuxinana (Kuqikelelwe) | 1.84±0.1 g/cm3 | Ubushushu: 20 °C; Cinezela: 760 Torr |
| pKa (Kuxelwe kwangaphambili) | 13.13±0.70 | Owona bushushu be-Acidic Temp: 25 °C |
Uncumo lweCanonical
OCC1OC(N2C= NC=3C(= NC= NC32)N)C(OC)C1O
Isomeric UNCUMA
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
Isitshixo se-InchI
FPUGCISOLXNPPC-IOSLPCCCSA-N
2 Amanye Amagama ale nto
2′-O-Methyladenosine (ACI); Cordysinin B
Iipropati ezikhoyo
Thermal
| Ipropati | Ixabiso | Umthombo wemeko |
| Indawo yokunyibilika | 204-206 °C | (1) I-CAS |
(1) uMartinez-Montero, uSaul; Ijenali yaseYurophu ye-Organic Chemistry, (2009) (19), 3265-3271, S3265/1-S3265/23, CAplus
ISpectra ekhoyo
1 H NMR
13 C NMR
IR
IMisa
Iipropati ezikhoyo
Ibhayoloji
Ikhemikhali
Ukuxinana
Lipinski
Ulwakhiwo olunxulumeneyo
Thermal
| Ipropati | Ixabiso | Imeko | Umthombo |
| I-Bioconcentration Factor | 1.0 | pH 1; Ubushushu: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | pH 2; Ubushushu: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | pH 3; Ubushushu: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.0 | pH 4; Ubushushu: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.78 | pH 5; Ubushushu: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.97 | pH 6; Ubushushu: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.99 | pH 7; Ubushushu: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.99 | pH 8; Ubushushu: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1.99 | pH 9; Ubushushu: 25 °C | (1) ACD |
| Umthombo wemeko yeXabiso lePropati |
| I-Bioconcentration Factor 1.99 pH 10; Temp: 25 °C (1) ACD |
(1) Kubalwa kusetyenziswa uPhuhliso lweKhemistry oluPhezulu (ACD/Labs) iSoftware V11.02 (© 1994-2023 ACD/Labs)
| Ipropati | Ixabiso | Imeko | Umthombo |
| Koc | 1.0 | pH 1; Ubushushu: 25 °C | (1) ACD |
| Koc | 1.0 | pH 2; Ubushushu: 25 °C | (1) ACD |
| Koc | 4.54 | pH 3; Ubushushu: 25 °C | (1) ACD |
| Koc | 26.0 | pH 4; Ubushushu: 25 °C | (1) ACD |
| Koc | 51.0 | pH 5; Ubushushu: 25 °C | (1) ACD |
| Koc | 56.4 | pH 6; Ubushushu: 25 °C | (1) ACD |
| Koc | 57.0 | pH 7; Ubushushu: 25 °C | (1) ACD |
| Koc | 57.1 | pH 8; Ubushushu: 25 °C | (1) ACD |
| Koc | 57.1 | pH 9; Ubushushu: 25 °C | (1) ACD |
| Koc | 57.0 | pH 10; Ubushushu: 25 °C | (1) ACD |
| logD | -1.70 | pH 1; Ubushushu: 25 °C | (1) ACD |
| logD | -1.25 | pH 2; Ubushushu: 25 °C | (1) ACD |
| logD | -0.40 | pH 3; Ubushushu: 25 °C | (1) ACD |
| logD | 0.36 | pH 4; Ubushushu: 25 °C | (1) ACD |
| logD | 0.65 | pH 5; Ubushushu: 25 °C | (1) ACD |
| logD | 0.69 | pH 6; Ubushushu: 25 °C | (1) ACD |
| logD | 0.70 | pH 7; Ubushushu: 25 °C | (1) ACD |
| logD | 0.70 | pH 8; Ubushushu: 25 °C | (1) ACD |
| logD | 0.70 | pH 9; Ubushushu: 25 °C | (1) ACD |
| logD | 0.70 | pH 10; Ubushushu: 25 °C | (1) ACD |
| logP | 0.697±0.596 | Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMass Intrinsic | 3.7 g/L | Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kobuninzi | 886 g/L | pH 1; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kobuninzi | 309 g/L | pH 2; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kobuninzi | 45 g/L | pH 3; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kobuninzi | 7.9 g/L | pH 4; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kobuninzi | 3.9 g/L | pH 5; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kobuninzi | 3.7 g/L | pH 6; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kobuninzi | 3.7 g/L | pH 7; Ubushushu: 25 °C | (1) ACD |
| Ipropati | Ixabiso | Imeko | Umthombo |
| Ukunyibilika kobuninzi | 3.7 g/L | pH 8; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kobuninzi | 3.7 g/L | pH 9; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kobuninzi | 3.7 g/L | pH 10; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kobuninzi | 3.7 g/L | Amanzi angaphazanyiswanga pH 8.07; Ubushushu: 25 °C | (1) ACD |
| I-Molar Intrinsic Solubility | 0.013 mol/L | Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMolar | 3.15 mol/L | pH 1; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMolar | 1.10 mol/L | pH 2; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMolar | 0.16 mol/L | pH 3; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMolar | 0.028 mol/L | pH 4; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMolar | 0.014 mol/L | pH 5; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMolar | 0.013 mol/L | pH 6; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMolar | 0.013 mol/L | pH 7; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMolar | 0.013 mol/L | pH 8; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMolar | 0.013 mol/L | pH 9; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMolar | 0.013 mol/L | pH 10; Ubushushu: 25 °C | (1) ACD |
| Ukunyibilika kweMolar | 0.013 mol/L | Amanzi angaphazanyiswanga pH 8.07; Ubushushu: 25 °C | (1) ACD |
| Ubunzima beMolekyuli | 281.27 | ||
| pKa | 13.13±0.70 | Owona bushushu be-Acidic Temp: 25 °C | (1) ACD |
| pKa | 3.82±0.10 | Eyona Tempile iSiseko: 25 °C | (1) ACD |
| Uxinzelelo lomphunga | 2.02 x 10-16 Torr | Ubushushu: 25 °C | (1) ACD |
(1) Kubalwa kusetyenziswa uPhuhliso lweKhemistry oluPhezulu (ACD/Labs) iSoftware V11.02 (© 1994-2023 ACD/Labs)
| Ipropati | Ixabiso | Imeko | Umthombo |
| Ukuxinana | 1.84±0.1 g/cm3 | Ubushushu: 20 °C; Cinezela: 760 Torr | (1) ACD |
| Umthamo weMolar | 152.5±7.0 cm3/mol | Ubushushu: 20 °C; Cinezela: 760 Torr | (1) ACD |
(1) Kubalwa kusetyenziswa uPhuhliso lweKhemistry oluPhezulu (ACD/Labs) iSoftware V11.02 (© 1994-2023 ACD/Labs)
| Ipropati | Ixabiso | Umthombo wemeko |
| Iibhondi eziGuquguqukayo ngokukhululekileyo | 5 | (1) ACD |
| H Abamkeli | 9 | (1) ACD |
| H Abaxhasi | 4 | (1) ACD |
| Ipropati | Ixabiso | Imeko | Umthombo |
| H Umnikeli/uMamkeli Isambuku | 13 | (1) ACD | |
| logP | 0.697±0.596 | Ubushushu: 25 °C | (1) ACD |
| Ubunzima beMolekyuli | 281.27 |
(1) Kubalwa kusetyenziswa uPhuhliso lweKhemistry oluPhezulu (ACD/Labs) iSoftware V11.02 (© 1994-2023 ACD/Labs)
| Ipropati | Ixabiso | Umthombo wemeko |
| Indawo yePolar Surface | 129 A2 | (1) ACD |
(1) Kubalwa kusetyenziswa uPhuhliso lweKhemistry oluPhezulu (ACD/Labs) iSoftware V11.02 (© 1994-2023 ACD/Labs)
| Ipropati | Ixabiso | Imeko | Umthombo |
| Indawo yokubilisa | 623.8±65.0 °C | Cinezela: 760 Torr | (1) ACD |
| I-Enthalpy yoMphunga | 97.11±3.0 kJ/mol | Cinezela: 760 Torr | (1) ACD |
| Indawo yokuflasha | 331.0±34.3 °C | (1) ACD |
(1) Kubalwa kusetyenziswa uPhuhliso lweKhemistry oluPhezulu (ACD/Labs) iSoftware V11.02 (© 1994-2023 ACD/Labs)
ISpectra ekhoyo
1 H NMR
13 C NMR
| Ikhowudi | Ingxelo yobungozi | Umthombo |
| H303 | Inokuba yingozi xa iginyiwe | Ingcaphephe iCandwe |
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