C13H19N5O5 Adenozin, 2′ -O-(2-metoksietil)- (9CI, ACI)
CAS ro'yxatga olish raqami
168427-74-5
Asosiy jismoniy xususiyatlar | Qiymat | Vaziyat |
Molekulyar og'irlik | 325.32 | - |
Qaynoq nuqtasi (taxmin qilingan) | 639,0±65,0 °C | Matbuot: 760 Torr |
Zichlik (taxmin qilingan) | 1,70±0,1 g/sm3 | Harorat: 20 °C; Matbuot: 760 Torr |
pKa (taxmin qilingan) | 13,12±0,70 | Eng kislotali harorat: 25 °C |
Kanonik tabassum
OCC1OC(N2C= NC=3C(= NC= NC32)N)C(OCCOC)C1O
Izomerik tabassum
O(CCOC)[C@H]1[C@@H](O[C@H](CO)[C@H]1O)N2C=3C(N=C2)=C(N)N=CN3
InChI
InChI= 1S/C13H19N5O5/c1-21-2-3-22-10-9(20)7(4-19)23-13(10)18-6-17-8-11(14)15-5-16- 12(8)18/h5-7,9-10,13,19-20H,2-4H2,1H3, (H2,14,15,16)/t7-,9-,10-,13-/m1/s1
InChI kaliti
PUDXUJRJLRLJIU-QYVSTXNMSA-N
1 Ushbu moddaning boshqa nomi
2′ -O-(2-metoksietil)adenozin (ACI)
Spektrlar mavjud
1H NMR
13C NMR
Xususiyatlari mavjud
Biologik
Kimyoviy
Zichlik
Lipinskiy
Tuzilishi bilan bog'liq
Termal
Mulk | Qiymat | Vaziyat | Manba |
Biokonsentratsiya omili | 1.0 | pH 1; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.0 | pH 2; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.0 | pH 3; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.0 | pH 4; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.18 | pH 5; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.31 | pH 6; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.32 | pH 7; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.32 | pH 8; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.32 | pH 9; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.32 | pH 10; Harorat: 25 °C | (1) ACD |
(1) Ilg'or kimyoni ishlab chiqish (ACD/Labs) V11.02 dasturiy ta'minoti yordamida hisoblangan (© 1994-2023 ACD/Labs)
Mulk | Qiymat | Vaziyat | Manba |
Koch | 1.0 | pH 1; Harorat: 25 °C | (1) ACD |
Koch | 1.0 | pH 2; Harorat: 25 °C | (1) ACD |
Koch | 3.39 | pH 3; Harorat: 25 °C | (1) ACD |
Koch | 19.4 | pH 4; Harorat: 25 °C | (1) ACD |
Koch | 38,0 | pH 5; Harorat: 25 °C | (1) ACD |
Koch | 42.0 | pH 6; Harorat: 25 °C | (1) ACD |
Koch | 42.5 | pH 7; Harorat: 25 °C | (1) ACD |
Mulk | Qiymat | Vaziyat | Manba |
Koch | 42.5 | pH 8; Harorat: 25 °C | (1) ACD |
Koch | 42.5 | pH 9; Harorat: 25 °C | (1) ACD |
Koch | 42.5 | pH 10; Harorat: 25 °C | (1) ACD |
logD | -1,94 | pH 1; Harorat: 25 °C | (1) ACD |
logD | -1,48 | pH 2; Harorat: 25 °C | (1) ACD |
logD | -0,64 | pH 3; Harorat: 25 °C | (1) ACD |
logD | 0,12 | pH 4; Harorat: 25 °C | (1) ACD |
logD | 0,41 | pH 5; Harorat: 25 °C | (1) ACD |
logD | 0,46 | pH 6; Harorat: 25 °C | (1) ACD |
logD | 0,46 | pH 7; Harorat: 25 °C | (1) ACD |
logD | 0,46 | pH 8; Harorat: 25 °C | (1) ACD |
logD | 0,46 | pH 9; Harorat: 25 °C | (1) ACD |
logD | 0,46 | pH 10; Harorat: 25 °C | (1) ACD |
logP | 0,462±0,647 | Harorat: 25 °C | (1) ACD |
Massaning ichki eruvchanligi | 4,2 g/l | Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 999 g/l | pH 1; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 381 g/l | pH 2; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 55 g/l | pH 3; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 9,4 g/l | pH 4; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 4,9 g/l | pH 5; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 4,2 g/l | pH 6; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 4,2 g/l | pH 7; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 4,2 g/l | pH 8; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 4,2 g/l | pH 9; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 4,2 g/l | pH 10; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 4,2 g/l | Bufersiz suv pH 8,08; Harorat: 25 °C | (1) ACD |
Molar ichki eruvchanligi | 0,013 mol/l | Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 3,07 mol/l | pH 1; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 1,17 mol/l | pH 2; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 0,17 mol/l | pH 3; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 0,029 mol/l | pH 4; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 0,015 mol/l | pH 5; Harorat: 25 °C | (1) ACD |
Mulk | Qiymat | Vaziyat | Manba |
Molyar eruvchanlik | 0,013 mol/l | pH 6; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 0,013 mol/l | pH 7; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 0,013 mol/l | pH 8; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 0,013 mol/l | pH 9; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 0,013 mol/l | pH 10; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 0,013 mol/l | Bufersiz suv pH 8,08; Harorat: 25 °C | (1) ACD |
Molekulyar og'irlik | 325.32 | ||
pKa | 13,12±0,70 | Eng kislotali harorat: 25 °C | (1) ACD |
pKa | 3,82±0,10 | Eng asosiy harorat: 25 °C | (1) ACD |
Bug 'bosimi | 3,35 x 10-17 Torr | Harorat: 25 °C | (1) ACD |
(1) Ilg'or kimyoni ishlab chiqish (ACD/Labs) V11.02 dasturiy ta'minoti yordamida hisoblangan (© 1994-2023 ACD/Labs)
Mulk | Qiymat | Vaziyat | Manba |
Zichlik | 1,70±0,1 g/sm3 | Harorat: 20 °C; Matbuot: 760 Torr | (1) ACD |
Molyar hajm | 191,2±7,0 sm3/mol | Harorat: 20 °C; Matbuot: 760 Torr | (1) ACD |
(1) Ilg'or kimyoni ishlab chiqish (ACD/Labs) V11.02 dasturiy ta'minoti yordamida hisoblangan (© 1994-2023 ACD/Labs)
Mulk | Qiymat | Vaziyat | Manba |
Erkin aylanadigan obligatsiyalar | 8 | (1) ACD | |
H qabul qiluvchilar | 10 | (1) ACD | |
H Donorlar | 4 | (1) ACD | |
H Donor/akseptor summasi | 14 | (1) ACD | |
logP | 0,462±0,647 | Harorat: 25 °C | (1) ACD |
Molekulyar og'irlik | 325.32 |
(1) Ilg'or kimyoni ishlab chiqish (ACD/Labs) V11.02 dasturiy ta'minoti yordamida hisoblangan (© 1994-2023 ACD/Labs)
Mulk | Qiymat | Vaziyat manbai |
Qutb yuzasi maydoni | 138 A2 | (1) ACD |
(1) Ilg'or kimyoni ishlab chiqish (ACD/Labs) V11.02 dasturiy ta'minoti yordamida hisoblangan (© 1994-2023 ACD/Labs)
Mulk | Qiymat | Vaziyat | Manba |
Qaynash nuqtasi | 639,0±65,0 °C | Matbuot: 760 Torr | (1) ACD |
Bug'lanish entalpiyasi | 99,17±3,0 kJ/mol | Matbuot: 760 Torr | (1) ACD |
O't olish nuqtasi | 340,2±34,3 °C | (1) ACD |
(1) Ilg'or kimyoni ishlab chiqish (ACD/Labs) V11.02 dasturiy ta'minoti yordamida hisoblangan (© 1994-2023 ACD/Labs)
Spektrlar mavjud
1H NMR
13C NMR