![C30H30N2O8 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]- (9CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C30H30N2O8 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]- (9CI, ACI) Imaj ki prezante](https://cdn.globalso.com/nvchem/C30H30N2O8-Uridine.jpg)
C30H30N2O8 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]- (9CI, ACI)
| Pwopriyete fizik kle | Valè | Kondisyon |
| Pwa molekilè | 546.57 | - |
| Pwen fizyon (eksperimantal) | 111-112 °C | Sòlvan: Acetate etil |
| Dansite (Prevwa) | 1.343±0.06 g/cm3 | Tanperati: 20 °C;Press: 760 Torr |
| pKa (Prevwa) | 9.39±0.10 | Tanperati ki pi asid: 25 °C |
Canonical SMILES 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)C2O
Isomerik SMILES C(OC[C@H]1O[C@H]([C@H](O)[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/C30H30N2O8/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)39-18-24-26(34)27(35)28(40-24)32-
17-16-25(33)31-29(32)36/h3-17,24,26-28,34-35H,18H2,1-2H3,(H,31,33,36)/t24-,26 -,27-,28-/m1/s1
InChI kle
PCFSNQYXXACUHM-YULOIDQLSA-N
4 Lòt Non pou sibstans sa a
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]uridine (ACI);Uridine, 5′-O-[α,α-bis(p-methoxyphenyl)benzyl]- (7CI);5′-Dimethoxytrityl uridine;5′-O-(4,4′-Dimethoxytrityl)uridine
| Pwopriyete ki disponib |
| Tèmik |
Tèmik
| Pwopriyete | Valè | Kondisyon | Sous | |
| Pwen k ap fonn | 122-123 °C | (1) CAS | ||
| Pwen k ap fonn | 111-112 °C | Solvans: | Asetat etil | (2) CAS |
| Pwen k ap fonn | Gade Tèks konplè | (3) CAS | ||
(1) Zekri, Nega;Bilten Sosyete chimik peyi Letiopi, (2010), 24(2), 299-304, CAplus
(2) Patil, Premanand Ramrao;Journal of Chimi idrat kabòn, (2008), 27 (5), 279-293, CAplus
(3) Khalafi-Nezhad, Ali;Lèt tetraèd, (2004), 45 (36), 6737-6739, CAplus
Spectre ki disponib
1H RMN
13C RMN
Mass
| Pwopriyete ki disponib |
| Byolojik |
| Chimik |
| Dansite |
| Lipinski |
| Estrikti ki gen rapò |
Byolojik
| Pwopriyete | Valè | Kondisyon | Sous |
| Faktè byokonsantrasyon | 904 | pH 1;Tanperati: 25 °C | (1) ACD |
| Faktè byokonsantrasyon | 904 | pH 2;Tanperati: 25 °C | (1) ACD |
| Faktè byokonsantrasyon | 904 | pH 3;Tanperati: 25 °C | (1) ACD |
| Faktè byokonsantrasyon | 904 | pH 4;Tanperati: 25 °C | (1) ACD |
| Faktè byokonsantrasyon | 904 | pH 5;Tanperati: 25 °C | (1) ACD |
| Faktè byokonsantrasyon | 904 | pH 6;Tanperati: 25 °C | (1) ACD |
| Faktè byokonsantrasyon | 900 | pH 7;Tanperati: 25 °C | (1) ACD |
| Faktè byokonsantrasyon | 861 | pH 8;Tanperati: 25 °C | (1) ACD |
| Faktè byokonsantrasyon | 602 | pH 9;Tanperati: 25 °C | (1) ACD |
| Pwopriyete | Valè | Kondisyon | Sous |
| Faktè byokonsantrasyon | 156 | pH 10;Tanperati: 25 °C | (1) ACD |
(1) Kalkile avèk lojisyèl Devlopman Chimi Avanse (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Chimik
| Pwopriyete | Valè | Kondisyon | Sous |
| Koc | 4550 | pH 1;Tanperati: 25 °C | (1) ACD |
| Koc | 4550 | pH 2;Tanperati: 25 °C | (1) ACD |
| Koc | 4550 | pH 3;Tanperati: 25 °C | (1) ACD |
| Koc | 4550 | pH 4;Tanperati: 25 °C | (1) ACD |
| Koc | 4550 | pH 5;Tanperati: 25 °C | (1) ACD |
| Koc | 4540 | pH 6;Tanperati: 25 °C | (1) ACD |
| Koc | 4520 | pH 7;Tanperati: 25 °C | (1) ACD |
| Koc | 4330 | pH 8;Tanperati: 25 °C | (1) ACD |
| Koc | 3030 | pH 9;Tanperati: 25 °C | (1) ACD |
| Koc | 785 | pH 10;Tanperati: 25 °C | (1) ACD |
| logD | 4.19 | pH 1;Tanperati: 25 °C | (1) ACD |
| logD | 4.19 | pH 2;Tanperati: 25 °C | (1) ACD |
| logD | 4.19 | pH 3;Tanperati: 25 °C | (1) ACD |
| logD | 4.19 | pH 4;Tanperati: 25 °C | (1) ACD |
| logD | 4.19 | pH 5;Tanperati: 25 °C | (1) ACD |
| logD | 4.19 | pH 6;Tanperati: 25 °C | (1) ACD |
| logD | 4.19 | pH 7;Tanperati: 25 °C | (1) ACD |
| logD | 4.17 | pH 8;Tanperati: 25 °C | (1) ACD |
| logD | 4.02 | pH 9;Tanperati: 25 °C | (1) ACD |
| logD | 3.43 | pH 10;Tanperati: 25 °C | (1) ACD |
| logP | 4.192±0.628 | Tanperati: 25 °C | (1) ACD |
| Mass Intrinsèque Solibilite | 3.2 x 10-4 g/L | Tanperati: 25 °C | (1) ACD |
| Solibilite mas | 3.2 x 10-4 g/L | pH 1;Tanperati: 25 °C | (1) ACD |
| Solibilite mas | 3.2 x 10-4 g/L | pH 2;Tanperati: 25 °C | (1) ACD |
| Solibilite mas | 3.2 x 10-4 g/L | pH 3;Tanperati: 25 °C | (1) ACD |
| Solibilite mas | 3.2 x 10-4 g/L | pH 4;Tanperati: 25 °C | (1) ACD |
| Solibilite mas | 3.2 x 10-4 g/L | pH 5;Tanperati: 25 °C | (1) ACD |
| Solibilite mas | 3.2 x 10-4 g/L | pH 6;Tanperati: 25 °C | (1) ACD |
| Solibilite mas | 3.2 x 10-4 g/L | pH 7;Tanperati: 25 °C | (1) ACD |
| Pwopriyete | Valè | Kondisyon | Sous |
| Solibilite mas | 3.3 x 10-4 g/L | pH 8;Tanperati: 25 °C | (1) ACD |
| Solibilite mas | 4.8 x 10-4 g/L | pH 9;Tanperati: 25 °C | (1) ACD |
| Solibilite mas | 1.9 x 10-3 g/L | pH 10;Tanperati: 25 °C | (1) ACD |
| Solibilite mas | 3.2 x 10-4 g/L | Dlo san tampon pH 6.99;Tanperati: 25 °C | (1) ACD |
| Solibilite entrinsèk molè | 5.8 x 10-7 mol/L | Tanperati: 25 °C | (1) ACD |
| Solibilite molè | 5.8 x 10-7 mol/L | pH 1;Tanperati: 25 °C | (1) ACD |
| Solibilite molè | 5.8 x 10-7 mol/L | pH 2;Tanperati: 25 °C | (1) ACD |
| Solibilite molè | 5.8 x 10-7 mol/L | pH 3;Tanperati: 25 °C | (1) ACD |
| Solibilite molè | 5.8 x 10-7 mol/L | pH 4;Tanperati: 25 °C | (1) ACD |
| Solibilite molè | 5.8 x 10-7 mol/L | pH 5;Tanperati: 25 °C | (1) ACD |
| Solibilite molè | 5.8 x 10-7 mol/L | pH 6;Tanperati: 25 °C | (1) ACD |
| Solibilite molè | 5.8 x 10-7 mol/L | pH 7;Tanperati: 25 °C | (1) ACD |
| Solibilite molè | 6.1 x 10-7 mol/L | pH 8;Tanperati: 25 °C | (1) ACD |
| Solibilite molè | 8.7 x 10-7 mol/L | pH 9;Tanperati: 25 °C | (1) ACD |
| Solibilite molè | 3.4 x 10-6 mol/L | pH 10;Tanperati: 25 °C | (1) ACD |
| Solibilite molè | 5.8 x 10-7 mol/L | Dlo san tampon pH 6.99;Tanperati: 25 °C | (1) ACD |
| Pwa molekilè | 546.57 | ||
| pKa | 9.39±0.10 | Tanperati ki pi asid: 25 °C | (1) ACD |
(1) Kalkile avèk lojisyèl Devlopman Chimi Avanse (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Dansite
| Pwopriyete | Valè | Kondisyon | Sous |
| Dansite | 1.343±0.06 g/cm3 | Tanperati: 20 °C;Press: 760 Torr | (1) ACD |
| Volim molè | 406.9±3.0 cm3/mol | Tanperati: 20 °C;Press: 760 Torr | (1) ACD |
(1) Kalkile avèk lojisyèl Devlopman Chimi Avanse (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Pwopriyete | Valè | Kondisyon | Sous |
| Obligasyon ki ka vire lib | 11 | (1) ACD | |
| H Aseptè | 10 | (1) ACD | |
| H Donatè | 3 | (1) ACD | |
| H Sòm donatè/akseptè | 13 | (1) ACD | |
| logP | 4.192±0.628 | Tanperati: 25 °C | (1) ACD |
| Pwopriyete | Valè | Kondisyon | Sous |
| Pwa molekilè | 546.57 | ||
(1) Kalkile avèk lojisyèl Devlopman Chimi Avanse (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Estrikti ki gen rapò
| Pwopriyete | Valè | Kondisyon | Sous |
| Zòn Sifas Polè | 127 A2 | (1) ACD | |
(1) Kalkile avèk lojisyèl Devlopman Chimi Avanse (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Spectre ki disponib
1H RMN
13C RMN
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