![C40H49N4O9P Uridine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-methyl-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphoramide] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C40H49N4O9P Uridine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-methyl-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphoramide] (ACI) Whakaahua Whakaatu](https://cdn.globalso.com/nvchem/C40H49N4O9P-Uridine.png)
C40H49N4O9P Uridine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-methyl-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphoramide] (ACI)
Tau Rehita CAS
110764-79-9
H335, H331, H319, H315, H311, H301+H311+H331, H301
| Nga Ahuatanga Tinana Matua | Uara | Tikanga | |
| Taumaha rāpoi | 760.81 | - | |
| pKa (I matapaetia) | 9.39±0.10 | Te Mahana Waiwawa Nui: 25 °C |
Nga Ataata Canonical
N#CCCOP(OC1C(OC(N2C=CC(=O)NC2=O)C1OC)COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C( OC)C=C5)N(C(C)C)C(C)C
NGĀ ATA ISOMERIKA
C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](OC)[C@@ H](O1)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/C40H49N4O9P/c1-27(2)44(28(3)4)54(51-25-11-23-41)53-36-34(52-38(37(36)49-7)43- 24-22-35(45)42-39(43)46)26-50-40(29-1 2-9-8-10-13-29,30-14-18-32(47-5)19-15-30)31-16-20-33(48-6)21-17-31/h8- 10,12-22,24,27-28,34,36-38H,11,25-26H2,1-7H3,
(H,42,45,46)/t34-,36-,37-,38-,54?/m1/s1
Kī InChI
UVUOJOLPNDCIHL-XKZJCBTISA-N
1 Ētahi atu Ingoa mō tēnei matū
Uridine, 5′-O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-methyl-, 3′ - [2-cyanoethyl bis(1-methylethyl)phosphoramidi] (9CI)
Kei te waatea te Spectra
Mass
Nga rawa e waatea ana
Koiora
Te matū
Lipinski
Hanganga e Pa ana
| Taonga | Uara | Tikanga | Puna |
| Tauwehe Bioconcentration | 254 | pH 1; Te Mamahana: 25 °C | (1) ACD |
| Tauwehe Bioconcentration | 2050 | pH 2; Te Mamahana: 25 °C | (1) ACD |
| Tauwehe Bioconcentration | 15400 | pH 3; Te Mamahana: 25 °C | (1) ACD |
| Tauwehe Bioconcentration | 46000 | pH 4; Te Mamahana: 25 °C | (1) ACD |
| Tauwehe Bioconcentration | 57500 | pH 5; Te Mamahana: 25 °C | (1) ACD |
| Tauwehe Bioconcentration | 58900 | pH 6; Te Mamahana: 25 °C | (1) ACD |
| Tauwehe Bioconcentration | 58900 | pH 7; Te Mamahana: 25 °C | (1) ACD |
| Tauwehe Bioconcentration | 56800 | pH 8; Te Mamahana: 25 °C | (1) ACD |
| Tauwehe Bioconcentration | 42300 | pH 9; Te Mamahana: 25 °C | (1) ACD |
| Tauwehe Bioconcentration | 12200 | pH 10; Te Mamahana: 25 °C | (1) ACD |
(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)
| Taonga | Uara | Tikanga | Puna |
| Koc | 389 | pH 1; Te Mamahana: 25 °C | (1) ACD |
| Koc | 3140 | pH 2; Te Mamahana: 25 °C | (1) ACD |
| Koc | 23600 | pH 3; Te Mamahana: 25 °C | (1) ACD |
| Koc | 70500 | pH 4; Te Mamahana: 25 °C | (1) ACD |
| Koc | 88100 | pH 5; Te Mamahana: 25 °C | (1) ACD |
| Koc | 90300 | pH 6; Te Mamahana: 25 °C | (1) ACD |
| Koc | 90200 | pH 7; Te Mamahana: 25 °C | (1) ACD |
| Koc | 87100 | pH 8; Te Mamahana: 25 °C | (1) ACD |
| Koc | 64800 | pH 9; Te Mamahana: 25 °C | (1) ACD |
| Koc | 18700 | pH 10; Te Mamahana: 25 °C | (1) ACD |
| Taonga | Uara | Tikanga | Puna |
| rangitakiD | 4.21 | pH 1; Te Mamahana: 25 °C | (1) ACD |
| rangitakiD | 5.12 | pH 2; Te Mamahana: 25 °C | (1) ACD |
| rangitakiD | 6.00 | pH 3; Te Mamahana: 25 °C | (1) ACD |
| rangitakiD | 6.47 | pH 4; Te Mamahana: 25 °C | (1) ACD |
| rangitakiD | 6.57 | pH 5; Te Mamahana: 25 °C | (1) ACD |
| rangitakiD | 6.58 | pH 6; Te Mamahana: 25 °C | (1) ACD |
| rangitakiD | 6.58 | pH 7; Te Mamahana: 25 °C | (1) ACD |
| rangitakiD | 6.56 | pH 8; Te Mamahana: 25 °C | (1) ACD |
| rangitakiD | 6.44 | pH 9; Te Mamahana: 25 °C | (1) ACD |
| rangitakiD | 5.90 | pH 10; Te Mamahana: 25 °C | (1) ACD |
| rangitakiP | 6.581±0.646 | Te Mamahana: 25 °C | (1) ACD |
| Te Wairewa o roto | 8.4 x 10-5 g/L | Te Mamahana: 25 °C | (1) ACD |
| Wairewa Papatipu | 0.019 g/L | pH 1; Te Mamahana: 25 °C | (1) ACD |
| Wairewa Papatipu | 2.4 x 10-3 g/L | pH 2; Te Mamahana: 25 °C | (1) ACD |
| Wairewa Papatipu | 3.1 x 10-4 g/L | pH 3; Te Mamahana: 25 °C | (1) ACD |
| Wairewa Papatipu | 1.1 x 10-4 g/L | pH 4; Te Mamahana: 25 °C | (1) ACD |
| Wairewa Papatipu | 8.4 x 10-5 g/L | pH 5; Te Mamahana: 25 °C | (1) ACD |
| Wairewa Papatipu | 8.4 x 10-5 g/L | pH 6; Te Mamahana: 25 °C | (1) ACD |
| Wairewa Papatipu | 8.4 x 10-5 g/L | pH 7; Te Mamahana: 25 °C | (1) ACD |
| Wairewa Papatipu | 8.4 x 10-5 g/L | pH 8; Te Mamahana: 25 °C | (1) ACD |
| Wairewa Papatipu | 1.1 x 10-4 g/L | pH 9; Te Mamahana: 25 °C | (1) ACD |
| Wairewa Papatipu | 4.0 x 10-4 g/L | pH 10; Te Mamahana: 25 °C | (1) ACD |
| Wairewa Papatipu | 8.4 x 10-5 g/L | Te Wai Whakakore pH 7.00; Te Mamahana: 25 °C | (1) ACD |
| Molar Intrinsic Solubility | 1.1 x 10-7 mol/L | Te Mamahana: 25 °C | (1) ACD |
| Molar Solubility | 2.5 x 10-5 mol/L | pH 1; Te Mamahana: 25 °C | (1) ACD |
| Molar Solubility | 3.1 x 10-6 mol/L | pH 2; Te Mamahana: 25 °C | (1) ACD |
| Molar Solubility | 4.1 x 10-7 mol/L | pH 3; Te Mamahana: 25 °C | (1) ACD |
| Molar Solubility | 1.4 x 10-7 mol/L | pH 4; Te Mamahana: 25 °C | (1) ACD |
| Molar Solubility | 1.1 x 10-7 mol/L | pH 5; Te Mamahana: 25 °C | (1) ACD |
| Molar Solubility | 1.1 x 10-7 mol/L | pH 6; Te Mamahana: 25 °C | (1) ACD |
| Molar Solubility | 1.1 x 10-7 mol/L | pH 7; Te Mamahana: 25 °C | (1) ACD |
| Molar Solubility | 1.1 x 10-7 mol/L | pH 8; Te Mamahana: 25 °C | (1) ACD |
| Taonga | Uara | Tikanga | Puna |
| Molar Solubility | 1.5 x 10-7 mol/L | pH 9; Te Mamahana: 25 °C | (1) ACD |
| Molar Solubility | 5.2 x 10-7 mol/L | pH 10; Te Mamahana: 25 °C | (1) ACD |
| Molar Solubility | 1.1 x 10-7 mol/L | Te Wai Whakakore pH 7.00; Te Mamahana: 25 °C | (1) ACD |
| Taumaha rāpoi | 760.81 | ||
| pKa | 9.39±0.10 | Te Mahana Waiwawa Nui: 25 °C | (1) ACD |
| pKa | 3.45±0.70 | Te Mahana Matua: 25 °C | (1) ACD |
(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)
| Taonga | Uara | Tikanga | Puna |
| Nga here e taea te huri noa | 18 | (1) ACD | |
| H Nga Kaiwhiwhi | 13 | (1) ACD | |
| H Nga Kaituku | 1 | (1) ACD | |
| H Tapeke Kaituku/Kaiwhiwhi | 14 | (1) ACD | |
| rangitakiP | 6.581±0.646 | Te Mamahana: 25 °C | (1) ACD |
| Taumaha rāpoi | 760.81 |
(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)
| Taonga | Uara | Puna Tikanga |
| Rohe Mata Polar | 155 A2 | (1) ACD |
(1) I tatauhia ma te whakamahi i te Whanaketanga Matū Ake (ACD/Labs) Pūmanawa V11.02 (© 1994-2023 ACD/Labs)
Kei te waatea te Spectra
1 H NMR
13 C NMR
| Waehere | Tauākī mōrearea | Puna |
| H335 | Ka raru pea te manawa | Tohunga Manaaki |
| H331 | He paitini mena ka ngotea | Tohunga Manaaki |
| H319 | He nui te mamae o te kanohi | Tohunga Manaaki |
| H315 | Ka whakaparahako te kiri | Tohunga Manaaki |
| Waehere | Tauākī mōrearea | Puna |
| H311 | He paitini ki te pa ki te kiri | Tohunga Manaaki |
| H301+H311+H331 | He paitini ki te horomia, ka pa ki te kiri, ki te hongi ranei | Tohunga Manaaki |
| H301 | He paitini ki te horomia | Tohunga Manaaki |
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