![C30H29FN2O7 Uridin, 5'-O-[bis(4-methoxyphenyl)fenilmetil]-2'-deoxy-2'- fluoro- (9CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C30H29FN2O7 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-deoxy-2′- fluoro- (9CI, ACI) Imej Pilihan](https://cdn.globalso.com/nvchem/C30H29FN2O7-Uridine.jpg)
C30H29FN2O7 Uridin, 5'-O-[bis(4-methoxyphenyl)fenilmetil]-2'-deoxy-2'- fluoro- (9CI, ACI)
| Sifat Fizikal Utama | Nilai | keadaan |
| Berat Molekul | 548.56 | - |
| Takat Lebur (Eksperimen) | 118-120 °C | - |
| Ketumpatan (Diramalkan) | 1.38±0.1 g/cm3 | Suhu: 20 °C; Akhbar: 760 Torr |
| pKa (Diramalkan) | 9.39±0.10 | Suhu Paling Berasid: 25 °C |
SENYUMAN Canonical O=C1C=CN(C(=O)N1)C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C= C5)C(O)C2F
SENYUMAN Isomerik C(OC[C@H]1O[C@H]([C@H](F)[C@@H]1O)N2C(=O)NC(=O)C=C2)(C3= CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChI
InChI=1S/C30H29FN2O7/c1-37-22-12-8-20(9-13-22)30(19-6-4-3-5-7 -19,21-10-14-23(38-2)15-11-21)39-18-24-27(35)26(31)28(40-24)33
-17-16-25(34)32-29(33)36/h3-17,24,26-28,35H,18H2,1-2H3,(H,32,34,36)/t24-,26- ,27-,28-/m1/s1
Kunci InChI
CSSFZSSZXOCCJB-YULOIDQLSA-N
1 Nama Lain untuk Bahan ini
5'-O-[Bis(4-methoxyphenyl)phenylmethyl]-2'-deoxy-2'-fluorouridine (ACI)
Hartanah tersedia
terma
terma
| Harta benda | Nilai | keadaan | Sumber |
| Takat Lebur | 118-120 °C | (1) CAS | |
(1) Penjarla, Srishylam; Nukleosida, Nukleotida & Asid Nukleik, (2018), 37(4), 232-247, CAplus
Spectra tersedia
1H NMR
13C NMR
| Hartanah tersedia |
| Biologi |
| kimia |
| Ketumpatan |
| Lipinski |
| Berkaitan Struktur |
Biologi
| Harta benda | Nilai | keadaan | Sumber |
| Faktor Biopekatan | 3580 | pH 1; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 3580 | pH 2; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 3580 | pH 3; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 3580 | pH 4; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 3580 | pH 5; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 3580 | pH 6; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 3570 | pH 7; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 3430 | pH 8; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 2500 | pH 9; Suhu: 25 °C | (1) ACD |
| Faktor Biopekatan | 689 | pH 10; Suhu: 25 °C | (1) ACD |
(1) Dikira menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
kimia
| Harta benda | Nilai | keadaan | Sumber |
| Koc | 12200 | pH 1; Suhu: 25 °C | (1) ACD |
| Koc | 12200 | pH 2; Suhu: 25 °C | (1) ACD |
| Koc | 12200 | pH 3; Suhu: 25 °C | (1) ACD |
| Koc | 12200 | pH 4; Suhu: 25 °C | (1) ACD |
| Koc | 12200 | pH 5; Suhu: 25 °C | (1) ACD |
| Koc | 12200 | pH 6; Suhu: 25 °C | (1) ACD |
| Koc | 12100 | pH 7; Suhu: 25 °C | (1) ACD |
| Koc | 11700 | pH 8; Suhu: 25 °C | (1) ACD |
| Koc | 8480 | pH 9; Suhu: 25 °C | (1) ACD |
| Koc | 2340 | pH 10; Suhu: 25 °C | (1) ACD |
| logD | 4.98 | pH 1; Suhu: 25 °C | (1) ACD |
| logD | 4.98 | pH 2; Suhu: 25 °C | (1) ACD |
| logD | 4.98 | pH 3; Suhu: 25 °C | (1) ACD |
| logD | 4.98 | pH 4; Suhu: 25 °C | (1) ACD |
| logD | 4.98 | pH 5; Suhu: 25 °C | (1) ACD |
| logD | 4.98 | pH 6; Suhu: 25 °C | (1) ACD |
| logD | 4.98 | pH 7; Suhu: 25 °C | (1) ACD |
| logD | 4.96 | pH 8; Suhu: 25 °C | (1) ACD |
| logD | 4.82 | pH 9; Suhu: 25 °C | (1) ACD |
| logD | 4.26 | pH 10; Suhu: 25 °C | (1) ACD |
| logP | 4.979±0.563 | Suhu: 25 °C | (1) ACD |
| Keterlarutan Intrinsik Jisim | 9.9 x 10-5 g/L | Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 9.9 x 10-5 g/L | pH 1; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 9.9 x 10-5 g/L | pH 2; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 9.9 x 10-5 g/L | pH 3; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 9.9 x 10-5 g/L | pH 4; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 9.9 x 10-5 g/L | pH 5; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 9.9 x 10-5 g/L | pH 6; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 9.9 x 10-5 g/L | pH 7; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 9.9 x 10-5 g/L | pH 8; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 1.4 x 10-4 g/L | pH 9; Suhu: 25 °C | (1) ACD |
| Keterlarutan Jisim | 5.0 x 10-4 g/L | pH 10; Suhu: 25 °C | (1) ACD |
| Harta benda | Nilai | keadaan | Sumber |
| Keterlarutan Jisim | 9.9 x 10-5 g/L | Air Tidak Penampan pH 7.00; Suhu: 25 °C | (1) ACD |
| Keterlarutan Intrinsik Molar | 1.8 x 10-7 mol/L | Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.8 x 10-7 mol/L | pH 1; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.8 x 10-7 mol/L | pH 2; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.8 x 10-7 mol/L | pH 3; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.8 x 10-7 mol/L | pH 4; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.8 x 10-7 mol/L | pH 5; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.8 x 10-7 mol/L | pH 6; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.8 x 10-7 mol/L | pH 7; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.8 x 10-7 mol/L | pH 8; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 2.5 x 10-7 mol/L | pH 9; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 9.2 x 10-7 mol/L | pH 10; Suhu: 25 °C | (1) ACD |
| Keterlarutan Molar | 1.8 x 10-7 mol/L | Air Tidak Penampan pH 7.00; Suhu: 25 °C | (1) ACD |
| Berat Molekul | 548.56 | ||
| pKa | 9.39±0.10 | Suhu Paling Berasid: 25 °C | (1) ACD |
(1) Dikira menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Ketumpatan
| Harta benda | Nilai | keadaan | Sumber |
| Ketumpatan | 1.38±0.1 g/cm3 | Suhu: 20 °C; Akhbar: 760 Torr | (1) ACD |
| Isipadu Molar | 395.8±5.0 cm3/mol | Suhu: 20 °C; Akhbar: 760 Torr | (1) ACD |
(1) Dikira menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Harta benda | Nilai | keadaan | Sumber |
| Bon Boleh Putar Bebas | 10 | (1) ACD | |
| H Penerima | 9 | (1) ACD | |
| H Penderma | 2 | (1) ACD | |
| H Jumlah Penderma/Penerima | 11 | (1) ACD | |
| logP | 4.979±0.563 | Suhu: 25 °C | (1) ACD |
| Berat Molekul | 548.56 |
(1) Dikira menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Berkaitan Struktur
| Harta benda | Nilai | keadaan | Sumber |
| Kawasan Permukaan Kutub | 107 A2 | (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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