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C30h30n2o8 uridine, 5'-o- [bis (4-methovyphenyl) fenylmethyl] - (9ci, aci)
| Kaai fysike eigenskippen | Wearde | Betingst |
| Molekulêr gewicht | 546.57 | - |
| Melting Point (eksperiminteel) | 111-112 ° C | Solvent: ethyl acetate |
| Tichtheid (foarsizze) | 1.343 ± 0,06 g / cm3 | Temp: 20 ° C; Parse: 760 Torr |
| PKA (foarsizze) | 9.39 ± 0.10 | Meast Acidic Temp: 25 ° C |
Kanonyske glimkes o = c1c = cn (c (= o) n1) c2oc (cc = c (cc = c (c4) c = c = c (cv = c (c5) c = c5) c (o) c2o
Isomeryske glimket c (OC [C @ h] ([c @ @ = (= c (= c2) (c3 = c *) (c4 = c (c4) c = c = c00 = cc = c5
Inchi
Inchi = 1s / c30h30o23 / c1-37-22-12-8-20 (9-13-22) 30 (19-13-22-5-6-19.21-14-23 (38-2) 15-11-21) 39-18-24-26 (34) 27 (35) 28 (40-24) 32-
17-16-25 (33) 31-29 (32) 36 / H3-17,24,26-28,34-35-6- 18h2,1-2H3, (H, 31,33,36) / T24-, 26-, 26-, 26-, 27-, 28- / M1 / S1
Inchi-kaai
PCFSNQYXXACUHM-YULOIDQLSA-N
4 oare nammen foar dizze substansje
5'-o- [bis (4-methovyphenyl) fenylmethyl] uridine (aci); Uridine, 5'-o- [α, α, α-bis (p-methovyphenyl) benzyl] - (7ci); 5'--dimethoxytrityyl uridine; 5'-o- (4,4'-dimethoxytrityl) uridine
| Eigenskippen beskikber |
| Thermal |
Thermal
| Besit | Wearde | Betingst | Boarne | |
| Melting Point | 122-123 ° C | (1) CAS | ||
| Melting Point | 111-112 ° C | Solvent: | Ethyl Acetate | (2) CAS |
| Melting Point | Sjoch folsleine tekst | (3) CAS | ||
(1) Zekri, Negar; Bulletin fan 'e gemyske maatskippij fan Ethiopië, (2010), 24 (2), 299-304, Caplus
(2) Patil, Premanand Ramrao; Journal of Carbohydrate Chemistry, (2008), 27 (5), 279-293, Caplus
(3) Khalafi-Nezhad, Ali; Tetrahedron letters, (2004), 45 (36), 6737-6739, Caplus
Spectra te krijen
1h nmr
13C NMR
Mis
| Eigenskippen beskikber |
| Biologysk |
| Gemysk |
| Densheid |
| Lipinski |
| Struktuer relatearre |
Biologysk
| Besit | Wearde | Betingst | Boarne |
| Bioconcentration Factor | 904 | pH 1; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 904 | pH 2; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 904 | pH 3; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 904 | pH 4; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 904 | pH 5; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 904 | pH 6; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 900 | pH 7; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 861 | pH 8; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 602 | pH 9; Temp: 25 ° C | (1) ACD |
| Besit | Wearde | Betingst | Boarne |
| Bioconcentration Factor | 156 | pH 10; Temp: 25 ° C | (1) ACD |
(1) Berekkene mei avansearre Chemy Untwikkeling (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)
Gemysk
| Besit | Wearde | Betingst | Boarne |
| Koc | 4550 | pH 1; Temp: 25 ° C | (1) ACD |
| Koc | 4550 | pH 2; Temp: 25 ° C | (1) ACD |
| Koc | 4550 | pH 3; Temp: 25 ° C | (1) ACD |
| Koc | 4550 | pH 4; Temp: 25 ° C | (1) ACD |
| Koc | 4550 | pH 5; Temp: 25 ° C | (1) ACD |
| Koc | 4540 | pH 6; Temp: 25 ° C | (1) ACD |
| Koc | 45-200 | pH 7; Temp: 25 ° C | (1) ACD |
| Koc | 4330 | pH 8; Temp: 25 ° C | (1) ACD |
| Koc | 3030 | pH 9; Temp: 25 ° C | (1) ACD |
| Koc | 785 | pH 10; Temp: 25 ° C | (1) ACD |
| Logd | 4,19 | pH 1; Temp: 25 ° C | (1) ACD |
| Logd | 4,19 | pH 2; Temp: 25 ° C | (1) ACD |
| Logd | 4,19 | pH 3; Temp: 25 ° C | (1) ACD |
| Logd | 4,19 | pH 4; Temp: 25 ° C | (1) ACD |
| Logd | 4,19 | pH 5; Temp: 25 ° C | (1) ACD |
| Logd | 4,19 | pH 6; Temp: 25 ° C | (1) ACD |
| Logd | 4,19 | pH 7; Temp: 25 ° C | (1) ACD |
| Logd | 4.17 | pH 8; Temp: 25 ° C | (1) ACD |
| Logd | 4.02 | pH 9; Temp: 25 ° C | (1) ACD |
| Logd | 3.43 | pH 10; Temp: 25 ° C | (1) ACD |
| Logp | 4.192 ± 0.628 | Temp: 25 ° C | (1) ACD |
| Massa intrinsike oplosmiddel | 3.2 x 10-4 G / L | Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.2 x 10-4 G / L | pH 1; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.2 x 10-4 G / L | pH 2; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.2 x 10-4 G / L | pH 3; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.2 x 10-4 G / L | pH 4; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.2 x 10-4 G / L | pH 5; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.2 x 10-4 G / L | pH 6; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.2 x 10-4 G / L | pH 7; Temp: 25 ° C | (1) ACD |
| Besit | Wearde | Betingst | Boarne |
| Massa-oplosberens | 3.3 x 10-4 G / L | pH 8; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 4,8 x 10-4 G / L | pH 9; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 1,9 x 10-3 g / l | pH 10; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.2 x 10-4 G / L | Unbuffered water phel 6; Temp: 25 ° C | (1) ACD |
| Molêre yntrinsike oplosmiddel | 5,8 x 10-7 Mol / L | Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 5,8 x 10-7 Mol / L | pH 1; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 5,8 x 10-7 Mol / L | pH 2; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 5,8 x 10-7 Mol / L | pH 3; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 5,8 x 10-7 Mol / L | pH 4; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 5,8 x 10-7 Mol / L | pH 5; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 5,8 x 10-7 Mol / L | pH 6; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 5,8 x 10-7 Mol / L | pH 7; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 6.1 X 10-7 Mol / L | pH 8; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 8,7 x 10-7 Mol / L | pH 9; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 3.4 x 10-6 Mol / L | pH 10; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 5,8 x 10-7 Mol / L | Unbuffered water phel 6; Temp: 25 ° C | (1) ACD |
| Molekulêr gewicht | 546.57 | ||
| pka | 9.39 ± 0.10 | Meast Acidic Temp: 25 ° C | (1) ACD |
(1) Berekkene mei avansearre Chemy Untwikkeling (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)
Densheid
| Besit | Wearde | Betingst | Boarne |
| Densheid | 1.343 ± 0,06 g / cm3 | Temp: 20 ° C; Parse: 760 Torr | (1) ACD |
| Molar volume | 406.9 ± 3.0 cm3 / Mol | Temp: 20 ° C; Parse: 760 Torr | (1) ACD |
(1) Berekkene mei avansearre Chemy Untwikkeling (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)
Lipinski
| Besit | Wearde | Betingst | Boarne |
| Frij rotatbere bonnen | 11 | (1) ACD | |
| H akseptearders | 10 | (1) ACD | |
| H Donors | 3 | (1) ACD | |
| H Donor / akseptearje SUM | 13 | (1) ACD | |
| Logp | 4.192 ± 0.628 | Temp: 25 ° C | (1) ACD |
| Besit | Wearde | Betingst | Boarne |
| Molekulêr gewicht | 546.57 | ||
(1) Berekkene mei avansearre Chemy Untwikkeling (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)
Struktuer relatearre
| Besit | Wearde | Betingst | Boarne |
| Polar oerflak | 127 a2 | (1) ACD | |
(1) Berekkene mei avansearre Chemy Untwikkeling (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)
Spectra te krijen
1h nmr
13C NMR
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