C13H19N5O5 Adenosin, 2′-O-(2-metoksi etil)- (9CI, ACI)
Nomor Registrasi CAS
Nomor telepon 168427-74-5
| Sifat Fisik Utama | Nilai | Kondisi |
| Berat Molekul | 325.32 | - |
| Titik Didih (Diprediksi) | 639,0±65,0 °C | Tekan: 760 Torr |
| Kepadatan (Diprediksi) | 1,70±0,1 gram/cm3 | Suhu: 20 °C; Tekanan: 760 Torr |
| pKa (Diprediksi) | 13,12±0,70 | Suhu Paling Asam: 25 °C |
SENYUM KANONIK
OCC1OC(N2C= NC=3C(= NC= NC32)N)C(OCCOC)C1O
SENYUM ISMER
O(CCOC)[C@H]1[C@@H](O[C@H](CO)[C@H]1O)N2C=3C(N=C2)=C(N)N=CN3
Di Cina
Dalam ChI= 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/jam5-7,9-10,13,19-20H,2-4H2,1H3, (H2,14,15,16)/t7-,9-,10-,13-/m1/s1
Kunci InChI
PUDXUJRJLRLJIU-QYVSTXNMSA-N
1 Nama Lain untuk Zat Ini
2′ -O-(2-Metoksi etil)adenosin (ACI)
Spektrum tersedia
1H NMR
NMR 13C
Properti tersedia
Biologis
Kimia
Kepadatan
Lipinski
Struktur Terkait
Panas
| Milik | Nilai | Kondisi | Sumber |
| Faktor Biokonsentrasi | 1.0 | pH 1; Suhu: 25 °C | (1) ACD |
| Faktor Biokonsentrasi | 1.0 | pH 2; Suhu: 25 °C | (1) ACD |
| Faktor Biokonsentrasi | 1.0 | pH 3; Suhu: 25 °C | (1) ACD |
| Faktor Biokonsentrasi | 1.0 | pH 4; Suhu: 25 °C | (1) ACD |
| Faktor Biokonsentrasi | 1.18 | pH 5; Suhu: 25 °C | (1) ACD |
| Faktor Biokonsentrasi | 1.31 | pH 6; Suhu: 25 °C | (1) ACD |
| Faktor Biokonsentrasi | 1.32 | pH 7; Suhu: 25 °C | (1) ACD |
| Faktor Biokonsentrasi | 1.32 | pH 8; Suhu: 25 °C | (1) ACD |
| Faktor Biokonsentrasi | 1.32 | pH 9; Suhu: 25 °C | (1) ACD |
| Faktor Biokonsentrasi | 1.32 | pH 10; Suhu: 25 °C | (1) ACD |
(1) Dihitung menggunakan Perangkat Lunak Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Milik | Nilai | Kondisi | Sumber |
| Koc | 1.0 | pH 1; Suhu: 25 °C | (1) ACD |
| Koc | 1.0 | pH 2; Suhu: 25 °C | (1) ACD |
| Koc | 3.39 | pH 3; Suhu: 25 °C | (1) ACD |
| Koc | 19.4 | pH 4; Suhu: 25 °C | (1) ACD |
| Koc | 38.0 | pH 5; Suhu: 25 °C | (1) ACD |
| Koc | 42.0 | pH 6; Suhu: 25 °C | (1) ACD |
| Koc | 42.5 | pH 7; Suhu: 25 °C | (1) ACD |
| Milik | Nilai | Kondisi | Sumber |
| Koc | 42.5 | pH 8; Suhu: 25 °C | (1) ACD |
| Koc | 42.5 | pH 9; Suhu: 25 °C | (1) ACD |
| Koc | 42.5 | pH 10; Suhu: 25 °C | (1) ACD |
| catatan D | -1,94 | pH 1; Suhu: 25 °C | (1) ACD |
| catatan D | -1.48 | pH 2; Suhu: 25 °C | (1) ACD |
| catatan D | -0,64 | pH 3; Suhu: 25 °C | (1) ACD |
| catatan D | 0.12 | pH 4; Suhu: 25 °C | (1) ACD |
| catatan D | 0.41 | pH 5; Suhu: 25 °C | (1) ACD |
| catatan D | 0.46 | pH 6; Suhu: 25 °C | (1) ACD |
| catatan D | 0.46 | pH 7; Suhu: 25 °C | (1) ACD |
| catatan D | 0.46 | pH 8; Suhu: 25 °C | (1) ACD |
| catatan D | 0.46 | pH 9; Suhu: 25 °C | (1) ACD |
| catatan D | 0.46 | pH 10; Suhu: 25 °C | (1) ACD |
| catatan P | 0,462±0,647 | Suhu: 25 °C | (1) ACD |
| Kelarutan Intrinsik Massa | 4,2 gram/L | Suhu: 25 °C | (1) ACD |
| Kelarutan Massa | 999 gram/L | pH 1; Suhu: 25 °C | (1) ACD |
| Kelarutan Massa | 381 gram/liter | pH 2; Suhu: 25 °C | (1) ACD |
| Kelarutan Massa | 55 gram/liter | pH 3; Suhu: 25 °C | (1) ACD |
| Kelarutan Massa | 9,4 gram/L | pH 4; Suhu: 25 °C | (1) ACD |
| Kelarutan Massa | 4,9 gram/L | pH 5; Suhu: 25 °C | (1) ACD |
| Kelarutan Massa | 4,2 gram/L | pH 6; Suhu: 25 °C | (1) ACD |
| Kelarutan Massa | 4,2 gram/L | pH 7; Suhu: 25 °C | (1) ACD |
| Kelarutan Massa | 4,2 gram/L | pH 8; Suhu: 25 °C | (1) ACD |
| Kelarutan Massa | 4,2 gram/L | pH 9; Suhu: 25 °C | (1) ACD |
| Kelarutan Massa | 4,2 gram/L | pH 10; Suhu: 25 °C | (1) ACD |
| Kelarutan Massa | 4,2 gram/L | Air Tanpa Penyangga pH 8,08; Suhu: 25 °C | (1) ACD |
| Kelarutan Intrinsik Molar | 0,013 mol/liter | Suhu: 25 °C | (1) ACD |
| Kelarutan Molar | 3,07 mol/liter | pH 1; Suhu: 25 °C | (1) ACD |
| Kelarutan Molar | 1,17 mol/liter | pH 2; Suhu: 25 °C | (1) ACD |
| Kelarutan Molar | 0,17 mol/liter | pH 3; Suhu: 25 °C | (1) ACD |
| Kelarutan Molar | 0,029 mol/liter | pH 4; Suhu: 25 °C | (1) ACD |
| Kelarutan Molar | 0,015 mol/liter | pH 5; Suhu: 25 °C | (1) ACD |
| Milik | Nilai | Kondisi | Sumber |
| Kelarutan Molar | 0,013 mol/liter | pH 6; Suhu: 25 °C | (1) ACD |
| Kelarutan Molar | 0,013 mol/liter | pH 7; Suhu: 25 °C | (1) ACD |
| Kelarutan Molar | 0,013 mol/liter | pH 8; Suhu: 25 °C | (1) ACD |
| Kelarutan Molar | 0,013 mol/liter | pH 9; Suhu: 25 °C | (1) ACD |
| Kelarutan Molar | 0,013 mol/liter | pH 10; Suhu: 25 °C | (1) ACD |
| Kelarutan Molar | 0,013 mol/liter | Air Tanpa Penyangga pH 8,08; Suhu: 25 °C | (1) ACD |
| Berat Molekul | 325.32 | ||
| pKa | 13,12±0,70 | Suhu Paling Asam: 25 °C | (1) ACD |
| pKa | 3,82±0,10 | Suhu Paling Dasar: 25 °C | (1) ACD |
| Tekanan Uap | 3,35 x 10-17 Torr (berat jenis) | Suhu: 25 °C | (1) ACD |
(1) Dihitung menggunakan Perangkat Lunak Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Milik | Nilai | Kondisi | Sumber |
| Kepadatan | 1,70±0,1 gram/cm3 | Suhu: 20 °C; Tekanan: 760 Torr | (1) ACD |
| Volume Molar | 191,2±7,0 cm3/mol | Suhu: 20 °C; Tekanan: 760 Torr | (1) ACD |
(1) Dihitung menggunakan Perangkat Lunak Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Milik | Nilai | Kondisi | Sumber |
| Obligasi yang Dapat Diputar Secara Bebas | 8 | (1) ACD | |
| Akseptor H | 10 | (1) ACD | |
| Donor H | 4 | (1) ACD | |
| H Jumlah Donor/Akseptor | 14 | (1) ACD | |
| catatan P | 0,462±0,647 | Suhu: 25 °C | (1) ACD |
| Berat Molekul | 325.32 |
(1) Dihitung menggunakan Perangkat Lunak Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Milik | Nilai | Kondisi Sumber |
| Luas Permukaan Kutub | 138 Halaman A2 | (1) ACD |
(1) Dihitung menggunakan Perangkat Lunak Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Milik | Nilai | Kondisi | Sumber |
| Titik didih | 639,0±65,0 °C | Tekan: 760 Torr | (1) ACD |
| Entalpi Penguapan | 99,17±3,0kJ/mol | Tekan: 760 Torr | (1) ACD |
| Titik nyala | 340,2±34,3 °C | (1) ACD |
(1) Dihitung menggunakan Perangkat Lunak Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Spektrum tersedia
1H NMR
NMR 13C
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