C13H19N5O6 Guanosine, 2′ -O-(2-methoxyethyl)- (9CI, ACI)
Nombor Pendaftaran CAS
473278-54-5
| Sifat Fizikal Utama | Nilai | keadaan |
| Berat Molekul | 341.32 | - |
| Takat Didih (Diramalkan) | 715.0±70.0 °C | Tekan: 760 Torr |
| Ketumpatan (Diramalkan) | 1.81±0.1 g/cm3 | Suhu: 20 °C; Tekan: 760 Torr |
| pKa (Diramalkan) | 13.20±0.70 | Suhu Paling Berasid: 25 °C |
SENYUM Canonical
O=C1N=C(N)NC2=C1N=CN2C3OC(CO)C(O)C3OCCOC
SENYUMAN Isomerik
O(CCOC)[C@H]1[C@@H](O[C@H](CO)[C@H]1O)N2C3=C(N=C2)C(=O)N=C( N)N3
InChI
InChI= 1S/C13H19N5O6/c1-22-2-3-23-9-8(20)6(4-19)24-12(9)18-5-15-7- 10(18)16-13(14)17-11(7)21/j5-6,8-9,12,19-20H,2-4H2,1H3,(H3, 14,16,17,21)/t6-,8-,9-,12-/m1/s1
Kunci InChI
DLLBJSLIKOKFHE-WOUKDFQISA-N
1 Nama Lain untuk Bahan ini
2′-O-(2-Methoxyethyl)guanosine (ACI)
Hartanah tersedia
Optik dan Penyebaran
terma
| Harta benda | Nilai | keadaan | Sumber |
| Kuasa Putaran Optik | -51 deg-mL/g-dm | c: 1.4 g/100ml; Pelarut: Diklorometana; λ: 589.3 nm; Suhu: 25 °C | (1) CAS |
| Kuasa Putaran Optik | Lihat Teks Penuh | (2) CAS |
(1) Wen, Ke; Jurnal Kimia Organik, (2002), 67(22), 7887-7889, CAplus
(2) Wen, Ke; Jurnal Kimia Organik, (2002), 67(22), 7887-7889, CAplus
| Harta benda | Nilai | Sumber Keadaan |
| Takat Lebur | Lihat Teks Penuh | (1) CAS |
(1) Taj, Shabbir Ali S.; Nukleosida, Nukleotida & Asid Nukleik, (2008), 27(9), 1024-1033, CAplus
Spectra tersedia
1 H NMR
13 C NMR
IR
Hartanah tersedia
Biologi
kimia
Ketumpatan
Lipinski
Berkaitan Struktur
terma
| Harta benda | Nilai | keadaan | Sumber |
| Faktor Biopekatan | 1.0 | pH 1; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 1.0 | pH 2; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 1.0 | pH 3; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 1.0 | pH 4; Suhu: 25 °C | (1) ACD |
| Harta benda | Nilai | keadaan | Sumber |
| Faktor Biopekatan | 1.0 | pH 5; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 1.0 | pH 6; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 1.0 | pH 7; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 1.0 | pH 8; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 1.0 | pH 9; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 1.0 | pH 10; Suhu: 25 °C | (1) ACD |
(1) Dikira menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Harta benda | Nilai | keadaan | Sumber |
| Koc | 1.0 | pH 1; Suhu: 25 °C | (1) ACD |
| Koc | 1.0 | pH 2; Suhu: 25 °C | (1) ACD |
| Koc | 4.27 | pH 3; Suhu: 25 °C | (1) ACD |
| Koc | 8.49 | pH 4; Suhu: 25 °C | (1) ACD |
| Koc | 9.43 | pH 5; Suhu: 25 °C | (1) ACD |
| Koc | 9.54 | pH 6; Suhu: 25 °C | (1) ACD |
| Koc | 9.55 | pH 7; Suhu: 25 °C | (1) ACD |
| Koc | 9.55 | pH 8; Suhu: 25 °C | (1) ACD |
| Koc | 9.55 | pH 9; Suhu: 25 °C | (1) ACD |
| Koc | 9.54 | pH 10; Suhu: 25 °C | (1) ACD |
| logD | -2.65 | pH 1; Suhu: 25 °C | (1) ACD |
| logD | -1.84 | pH 2; Suhu: 25 °C | (1) ACD |
| logD | -1.08 | pH 3; Suhu: 25 °C | (1) ACD |
| logD | -0.78 | pH 4; Suhu: 25 °C | (1) ACD |
| logD | -0.74 | pH 5; Suhu: 25 °C | (1) ACD |
| logD | -0.73 | pH 6; Suhu: 25 °C | (1) ACD |
| logD | -0.73 | pH 7; Suhu: 25 °C | (1) ACD |
| logD | -0.73 | pH 8; Suhu: 25 °C | (1) ACD |
| logD | -0.73 | pH 9; Suhu: 25 °C | (1) ACD |
| logD | -0.73 | pH 10; Suhu: 25 °C | (1) ACD |
| logP | -0.730±0.568 | Suhu: 25 °C | (1) ACD |
| Keterlarutan Intrinsik Jisim | 0.44 g/L | Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 38 g/L | pH 1; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 5.5 g/L | pH 2; Suhu: 25 °C | (1) ACD |
| Harta benda | Nilai | keadaan | Sumber |
| Keterlarutan Jisim | 0.96 g/L | pH 3; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 0.48 g/L | pH 4; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 0.44 g/L | pH 5; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 0.44 g/L | pH 6; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 0.44 g/L | pH 7; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 0.44 g/L | pH 8; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 0.44 g/L | pH 9; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 0.44 g/L | pH 10; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 0.44 g/L | Air Tidak Penampan pH 7.20; Suhu: 25 °C | (1) ACD |
| Keterlarutan Intrinsik Molar | 1.3 x 10-3 mol/L | Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 0.11 mol/L | pH 1; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 0.016 mol/L | pH 2; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 2.8 x 10-3 mol/L | pH 3; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.4 x 10-3 mol/L | pH 4; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.3 x 10-3 mol/L | pH 5; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.3 x 10-3 mol/L | pH 6; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.3 x 10-3 mol/L | pH 7; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.3 x 10-3 mol/L | pH 8; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.3 x 10-3 mol/L | pH 9; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.3 x 10-3 mol/L | pH 10; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.3 x 10-3 mol/L | Air Tidak Penampan pH 7.20; Suhu: 25 °C | (1) ACD |
| Berat Molekul | 341.32 | ||
| pKa | 13.20±0.70 | Suhu Paling Berasid: 25 °C | (1) ACD |
| pKa | 3.00±0.20 | Suhu Paling Asas: 25 °C | (1) ACD |
| Tekanan Wap | 1.86 x 10-21 Torr | Suhu: 25 °C | (1) ACD |
(1) Dikira menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Harta benda | Nilai | keadaan | Sumber |
| Ketumpatan | 1.81±0.1 g/cm3 | Suhu: 20 °C; Tekan: 760 Torr | (1) ACD |
| Isipadu Molar | 188.5±7.0 cm3/mol | Suhu: 20 °C; Tekan: 760 Torr | (1) ACD |
(1) Dikira menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Harta benda | Nilai | keadaan | Sumber |
| Bon Boleh Putar Bebas | 8 | (1) ACD | |
| H Penerima | 11 | (1) ACD | |
| H Penderma | 5 | (1) ACD | |
| H Jumlah Penderma/Penerima | 16 | (1) ACD | |
| logP | -0.730±0.568 | Suhu: 25 °C | (1) ACD |
| Berat Molekul | 341.32 |
(1) Dikira menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Harta benda | Nilai | Sumber Keadaan |
| Kawasan Permukaan Kutub | 153 A2 | (1) ACD |
(1) Dikira menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Harta benda | Nilai | keadaan | Sumber |
| Takat Didih | 715.0±70.0 °C | Tekan: 760 Torr | (1) ACD |
| Entalpi Pengewapan | 109.72±3.0 kJ/mol | Tekan: 760 Torr | (1) ACD |
| Titik Kilat | 386.2±35.7 °C | (1) ACD |
(1) Dikira menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Spectra tersedia
1H NMR
13C NMR
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