C11H16N6O4 Adenozin, 2-amino-2' -O-metil- (9CI, ACI)
CAS ro'yxatga olish raqami
80791-87-3
Asosiy jismoniy xususiyatlar | Qiymat | Vaziyat |
Molekulyar og'irlik | 296.28 | - |
Erish nuqtasi (eksperimental) | 121-122 ° S | Erituvchi: metanol |
Qaynoq nuqtasi (taxmin qilingan) | 733,2±70,0 °C | Matbuot: 760 Torr |
Zichlik (taxmin qilingan) | 1,98±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)N)C(OC)C1O
Izomerik tabassum
O(C)[C@H]1[C@H](N2C=3C(N=C2)=C(N)N=C(N)N3)O[C@H](CO)[C@H ]1O
InChI
InChI= 1S/C11H16N6O4/c1-20-7-6(19)4(2-18)21-10(7)17-3-14-5-8(12)15-11(13)16-9( 5)17/h3-4,6-7,10,18-19H,2H2,1H3,(H4,12,13,15,16) /t4-,6-,7-,10-/m1/s1
InChI kaliti
JLWUWXCKSOIFPS-KQYNXXCUSA-N
2 Ushbu moddaning boshqa nomlari
2-amino-2' -O-metiladenozin (ACI); 2′ -O-metil-2,6-diaminopurin ribozid
Xususiyatlari mavjud
Termal
Mulk | Qiymat | Vaziyat | Manba |
Erish nuqtasi | 121-122 ° S | Erituvchi: metanol | (1) CAS |
(1) Kore, Anilkumar R.; Nukleozidlar, nukleotidlar va nuklein kislotalar, (2006), 25(3), 307-314, CAplus
Spektrlar mavjud
UV va ko'rinadigan
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 | 1.0 | pH 5; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.0 | pH 6; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.0 | pH 7; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.0 | pH 8; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.0 | pH 9; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 1.0 | 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 qiymati Vaziyat Manba |
Koc 1,0 pH 1; Harorat: 25 °C (1) ACD |
Koc 1,0 pH 2; Harorat: 25 °C (1) ACD |
Koc 1,0 pH 3; Harorat: 25 °C (1) ACD |
Koc 1,21 pH 4; Harorat: 25 °C (1) ACD |
Koc 6,90 pH 5; Harorat: 25 °C (1) ACD |
Koc 13,5 pH 6; Harorat: 25 °C (1) ACD |
Koc 14,9 pH 7; Harorat: 25 °C (1) ACD |
Koc 15,1 pH 8; Harorat: 25 °C (1) ACD |
Koc 15,1 pH 9; Harorat: 25 °C (1) ACD |
Koc 15,1 pH 10; Harorat: 25 °C (1) ACD |
logD -2,85 pH 1; Harorat: 25 °C (1) ACD |
logD -2,76 pH 2; Harorat: 25 °C (1) ACD |
logD -2,31 pH 3; Harorat: 25 °C (1) ACD |
logD -1,46 pH 4; Harorat: 25 °C (1) ACD |
logD -0,70 pH 5; Harorat: 25 °C (1) ACD |
logD -0,41 pH 6; Harorat: 25 °C (1) ACD |
logD -0,37 pH 7; Harorat: 25 °C (1) ACD |
logD -0,36 pH 8; Harorat: 25 °C (1) ACD |
logD -0,36 pH 9; Harorat: 25 °C (1) ACD |
logD -0,36 pH 10; Harorat: 25 °C (1) ACD |
logP -0,363±0,611 Harorat: 25 °C (1) ACD |
Ommaviy eruvchanligi 1,6 g/L Harorat: 25 °C (1) ACD |
Ommaviy eruvchanligi 504 g/L pH 1; Harorat: 25 °C (1) ACD |
Ommaviy eruvchanligi 409 g/L pH 2; Harorat: 25 °C (1) ACD |
Ommaviy eruvchanligi 140 g/L pH 3; Harorat: 25 °C (1) ACD |
Ommaviy eruvchanligi 20 g/L pH 4; Harorat: 25 °C (1) ACD |
Ommaviy eruvchanligi 3,6 g/L pH 5; Harorat: 25 °C (1) ACD |
Ommaviy eruvchanligi 1,8 g/L pH 6; Harorat: 25 °C (1) ACD |
Ommaviy eruvchanligi 1,7 g/L pH 7; Harorat: 25 °C (1) ACD |
Ommaviy eruvchanligi 1,6 g/L pH 8; Harorat: 25 °C (1) ACD |
Ommaviy eruvchanligi 1,6 g/L pH 9; Harorat: 25 °C (1) ACD |
Ommaviy eruvchanligi 1,6 g/L 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 |
Zichlik | 1,98±0,1 g/sm3 | Harorat: 20 °C; Matbuot: 760 Torr | (1) ACD |
Molyar hajm | 149,3±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 | 5 | (1) ACD | |
H qabul qiluvchilar | 10 | (1) ACD | |
H Donorlar | 6 | (1) ACD | |
H Donor/akseptor summasi | 16 | (1) ACD | |
logP | -0,363±0,611 | Harorat: 25 °C | (1) ACD |
Molekulyar og'irlik | 296.28 |