![C30H29FN2O7 Uridine, 5′-O-[bis (4-methoxyphenyl) phenylmethyl]-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) Aworan Ti a ṣe afihan](https://cdn.globalso.com/nvchem/C30H29FN2O7-Uridine.jpg)
C30H29FN2O7 Uridine, 5′-O-[bis (4-methoxyphenyl) phenylmethyl]-2′-deoxy-2′- fluoro- (9CI, ACI)
| Key Properties Properties | Iye | Ipo |
| Òṣuwọn Molikula | 548.56 | - |
| Ibi Iyọ (Ayẹwo) | 118-120 °C | - |
| iwuwo (Asọtẹlẹ) | 1,38 ± 0,1 g / cm3 | Iwọn otutu: 20 °C; Tẹ: 760 Torr |
| pKa (Asọtẹlẹ) | 9.39 ± 0.10 | Pupọ Epo otutu: 25 °C |
SILES 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
Isomeric SMILES 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=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
InChi Key
CSSFZSSZXOCCJB-YULOIDQLSA-N
1 Oruko miiran fun Ohun elo yii
5'-O-[Bis (4-methoxyphenyl) phenylmethyl] -2'-deoxy-2'-fluorouridine (ACI)
Awọn ohun-ini ti o wa
Gbona
Gbona
| Ohun ini | Iye | Ipo | Orisun |
| Ojuami Iyo | 118-120 °C | (1) CAS | |
(1) Penjarla, Srishylam; Nucleosides, Nucleotides & Nucleic Acids, (2018), 37(4), 232-247, CAplus
Spectra wa
1H NMR
13C NMR
| Awọn ohun-ini ti o wa |
| Ti ibi |
| Kemikali |
| iwuwo |
| Lipinski |
| Ilana Jẹmọ |
Ti ibi
| Ohun ini | Iye | Ipo | Orisun |
| Bioconcentration ifosiwewe | 3580 | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 3580 | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 3580 | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 3580 | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 3580 | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 3580 | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 3570 | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 3430 | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 2500 | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 689 | pH 10; Iwọn otutu: 25 °C | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Kemikali
| Ohun ini | Iye | Ipo | Orisun |
| Koc | 12200 | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 12200 | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 12200 | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 12200 | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 12200 | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 12200 | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 12100 | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 11700 | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 8480 | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 2340 | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.98 | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.98 | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.98 | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.98 | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.98 | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.98 | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.98 | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.96 | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.82 | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| logD | 4.26 | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| logP | 4,979 ± 0.563 | Iwọn otutu: 25 °C | (1) ACD |
| Ibi Isoju Agbekale | 9.9 x 10-5 g/L | Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 9.9 x 10-5 g/L | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 9.9 x 10-5 g/L | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 9.9 x 10-5 g/L | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 9.9 x 10-5 g/L | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 9.9 x 10-5 g/L | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 9.9 x 10-5 g/L | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 9.9 x 10-5 g/L | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 9.9 x 10-5 g/L | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 1,4 x 10-4 g/L | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 5.0 x 10-4 g/L | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| Ohun ini | Iye | Ipo | Orisun |
| Ibi Solubility | 9.9 x 10-5 g/L | Omi ti a ko fi silẹ pH 7.00; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Inu inu Molar | 1,8 x 10-7 mol/L | Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1,8 x 10-7 mol/L | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1,8 x 10-7 mol/L | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1,8 x 10-7 mol/L | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1,8 x 10-7 mol/L | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1,8 x 10-7 mol/L | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1,8 x 10-7 mol/L | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1,8 x 10-7 mol/L | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1,8 x 10-7 mol/L | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 2.5 x 10-7 mol/L | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 9.2 x 10-7 mol/L | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 1,8 x 10-7 mol/L | Omi ti a ko fi silẹ pH 7.00; Iwọn otutu: 25 °C | (1) ACD |
| Òṣuwọn Molikula | 548.56 | ||
| pKa | 9.39 ± 0.10 | Pupọ Epo otutu: 25 °C | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
iwuwo
| Ohun ini | Iye | Ipo | Orisun |
| iwuwo | 1,38 ± 0,1 g / cm3 | Iwọn otutu: 20 °C; Tẹ: 760 Torr | (1) ACD |
| Iwọn didun Molar | 395,8 ± 5,0 cm3 / mol | Iwọn otutu: 20 °C; Tẹ: 760 Torr | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Ohun ini | Iye | Ipo | Orisun |
| Larọwọto Rotatable Bonds | 10 | (1) ACD | |
| H Awọn olugba | 9 | (1) ACD | |
| H Awọn oluranlọwọ | 2 | (1) ACD | |
| H Oluranlọwọ / Olugba Apapọ | 11 | (1) ACD | |
| logP | 4,979 ± 0.563 | Iwọn otutu: 25 °C | (1) ACD |
| Òṣuwọn Molikula | 548.56 |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Ilana Jẹmọ
| Ohun ini | Iye | Ipo | Orisun |
| Pola dada Area | 107 A2 | (1) ACD | |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra wa
1H NMR
13C NMR
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