![C50H58N7O9P Adenosine, N-benzoyl-5′-O- [bis (4-methoxyphenyl) phenylmethyl]-2′- O- (2-methoxyethyl) -, 3′- [2-cyanoethyl N, N-bis (1-methylethyl). phosphoramidite] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C50H58N7O9P Adenosine, N-benzoyl-5′-O- [bis (4-methoxyphenyl) phenylmethyl]-2′- O- (2-methoxyethyl) -, 3′- [2-cyanoethyl N, N-bis (1-methylethyl). ) phosphoramite] (ACI) Hoton da aka Fito](https://www.csnvchem.com/uploads/C50H58N7O9P-Adenosine.png)
C50H58N7O9P Adenosine, N-benzoyl-5′-O- [bis (4-methoxyphenyl) phenylmethyl]-2′- O- (2-methoxyethyl) -, 3′- [2-cyanoethyl N, N-bis (1-methylethyl). phosphoramidite] (ACI)
Lambar Rijistar CAS
251647-53-7
H302
| Mabuɗin Abubuwan Jiki | Daraja | Sharadi |
| Nauyin Kwayoyin Halitta | 932.01 | - |
| pKa (An annabta) | 7.87± 0.43 | Mafi yawan zafin jiki: 25 ° C |
MURMUSHI na Canonical
N#CCCOP(OC1C(OC(N2C= NC=3C(= NC= NC32)NC(=O)C=4C=CC=CC4)C1OCCOC)COC(C=5C=CC=CC5)(C6=CC=C) (OC)C=C6)C7=CC=C(OC)C=C7)N(C(C)C)C(C)C (C)
MURMUSHI
C(OC[C@H] 1[C@@H](OP(N(C)C)C(C)C)OCCC#N H](O1)N2C=3C(N=C2)=C(NC(=O)C4=CC=CC=C4)N=CN3)(C5=CC=C(OC)C=C5)(C6=CC) =C(OC)C=C6)C7=CC=CC=C7
InChi
InChi= 1S/C50H58N7O9P/c1-34(2)57(35(3)4)67(64-28-14-27-51)66-44-42(31-63-50(37-17-12-) 9-13-18-37,38-19-23-40(60-6)24-20-38) 3 9-21-25-41(61-7)26-22-39)65-49(45) (44)62-30-29-59-5)56-33-54-43-46(52-32-53-47(43)56)55-48(58)36-15-10-8-11 -16-36/h8-13,15-26, 32-35,42,44-45,49H,14,28-31H2,1-7H3,(H,52,53,55,58)/t42-, 44-,45-,49-,67?/m1/s1
InChi Key
VBYBQBHLYRLHG-HDMAWCRFSA-N
16 Wasu Sunaye na wannan Abu
Adenosine,Nbenzoyl-5'-O- [bis (4-methoxyphenyl) phenylmethyl]-2′-O(2-methoxyethyl) -, 3'- [2-cyanoethyl bis (1-methylethyl)
phosphoramite] (9CI); 16: PN: US20030211606 SHAFI: 19 da'awar jerin; 16: PN: US20030212017 SHAFI: 20 da'awar jerin; 17: PN: US20040005569 SHAFI: 22 da'awar jeri; 19: PN: US20040006030 SHAFI: 23 da'awar jerin; 19: PN: US20040014047
SHAFI: 21 da'awar jerin; 19: PN: US20040014049 SHAFI: 21 da'awar jerin; 20: PN: US20040005570 SHAFI: 20 da'awar
jerin; 20: PN: US20040014048 SHAFI: 21 da'awar jerin; 20: PN: US20040014050 SHAFI: 20 da'awar jerin; 21: PN: ku
S20040005565 SHAFI: 17- 22 da'awar jeri; 21: PN: US20040014051 SHAFI: 23 da'awar jeri; 22: PN: US20040014699 SHAFI: 20 da'awar jeri; 23: PN: US20040006029 SHAFI: 23 da'awar jeri; 23: PN: WO03106645 SHAFI: 73 da'awar jeri; 94: P N: US20040005707 SHAFI: 20 da'awar jeri
Spectra akwai
1 H NMR
13 C NMR
Farashin NMR
Properties akwai
Halittu
Chemical
Lipinski
Tsarin Yanayi
| Dukiya | Daraja | Sharadi | Source |
| Factor na Bioconcentration | 2680 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 71500 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 7.21 x 105 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.00 x 106 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.00 x 106 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.00 x 106 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.00 x 106 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 8.48 x 105 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 1.39 x 105 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 40300 | pH 10; Zazzabi: 25 ° C | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Dukiya | Daraja | Sharadi | Source |
| Koc | 1360 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Koc | 36300 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Koc | 3.66 x 105 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Koc | 1.13 x 106 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Dukiya | Daraja | Sharadi | Source |
| Koc | 1.42 x 106 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Koc | 1.42 x 106 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Koc | 1.17 x 106 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Koc | 4.30 x 105 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Koc | 70800 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Koc | 20500 | pH 10; Zazzabi: 25 ° C | (1) ACD |
| logD | 5.77 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| logD | 7.20 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| logD | 8.20 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| logD | 8.69 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| logD | 8.79 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| logD | 8.79 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| logD | 8.71 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| logD | 8.27 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| logD | 7.49 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.95 | pH 10; Zazzabi: 25 ° C | (1) ACD |
| logP | 8.803± 0.766 | Zazzabi: 25 ° C | (1) ACD |
| Mass Intrinsic Solubility | 5.4 x 10-5 g/L | Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 0.051 g/L | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 1.9 x 10-3 g/L | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 1.9 x 10-4 g/L | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 6.0 x 10-5 g/L | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 4.8 x 10-5 g/L | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 4.8 x 10-5 g/L | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 5.8 x 10-5 g/L | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 1.6 x 10-4 g/L | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 9.3 x 10-4 g/L | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 3.6 x 10-3 g/L | pH 10; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 5.7 x 10-5 g/L | Ruwan da ba a buƙata ba pH 6.97; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Ciki na Molar | 5.8 x 10-8 mol/L | Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 5.5 x 10-5 mol/L | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 2.0 x 10-6 mol/L | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Dukiya | Daraja | Sharadi | Source |
| Solubility na Molar | 2.0 x 10-7 mol/L | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 6.4 x 10-8 mol/L | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 5.1 x 10-8 mol/L | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 5.1 x 10-8 mol/L | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 6.2 x 10-8 mol/L | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 1.7 x 10-7 mol/L | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 1.0 x 10-6 mol/L | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 3.9 x 10-6 mol/L | pH 10; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 6.1 x 10-8 mol/L | Ruwan da ba a buƙata ba pH 6.97; Zazzabi: 25 ° C | (1) ACD |
| Nauyin Kwayoyin Halitta | 932.01 | ||
| pKa | 7.87± 0.43 | Mafi yawan zafin jiki: 25 ° C | (1) ACD |
| pKa | 3.45± 0.70 | Mafi Asalin Zazzabi: 25 ° C | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Dukiya | Daraja | Sharadi | Source |
| Ƙimar Rarraba Kyauta | 22 | (1) ACD | |
| H Masu karɓa | 16 | (1) ACD | |
| H Masu Ba da taimako | 1 | (1) ACD | |
| H Donor/Acceptor Sum | 17 | (1) ACD | |
| logP | 8.803± 0.766 | Zazzabi: 25 ° C | (1) ACD |
| Nauyin Kwayoyin Halitta | 932.01 |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Dukiya | Daraja | Tushen yanayi |
| Wuri Mai Girma | 187 A2 | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra akwai
1 H NMR
13 C NMR
| Tushen Bayanin Hazard na Code | |
| H302 Yana da illa idan an haɗiye shi | Rarraba Hukumar Kula da Sinadarai ta Turai (ECHA) & Lakabi Inventory - Sanarwa Rarrabawa da lakabi - sanarwar da aka fi sani, Hukumar Kula da Sinadarai ta Turai (ECHA) Rabewa&Kyakkyawan Lakabi - Faɗakarwar Rarrabawa da Lakabi - sanarwa mafi mahimmanci |
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