![C36h39n5o8 guanosine, 5'-o- [bis (4-methovhyPhenyl) fenylmethyl] -2'-methyl- n- (2-methyl-1-oxoprop) - (9ci, aci)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
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C36h39n5o8 guanosine, 5'-o- [bis (4-methovhyPhenyl) fenylmethyl] -2'-methyl- n- (2-methyl-1-oxoprop) - (9ci, aci)
| Kaai fysike eigenskippen | Wearde | Betingst |
| Molekulêr gewicht | 669.72 | - |
| Tichtheid (foarsizze) | 1,35 ± 0,1 g / cm3 | Temp: 20 ° C; Parse: 760 Torr |
| PKA (foarsizze) | 9,16 ± 0.20 | Meast Acidic Temp: 25 ° C |
Kanonyske glimkes o = c1n = c (nc (= o) c (c) c) nc2 = cn2c3oc (cv (cc = c = c = c = c (oc) c = c = c = c = c = c6-c3oc
Isomeryske glimkes
C (oc [c @ h] 1O [C @ h] (OC) (OC) [C @@ H] 1o) n = c (c4 = c (c4) c = c00) (c5 = c (cv = c (c5) c = cv
= Cc = c6
Inchi
Inchi = 1s / c36h31o8 / c1-21 (2) 32 (43) 32-31-31-31) 37-20-35) 37-20-35 (31) 34-30 (47-30 (47-30 (47-30) 19-48-36 (22-9-7-6-8-10-2 2,23-11-15-25 (45-23-23) 16-13-23) 24-13-17-26 (46-4) 18-14-24 / H6-18,20-60,27,29-30,22,42, (h2,1,39,40,43,44) / T27-, 29-, 29-, 34
- / m1 / s1
Inchi-kaai
Isqljorisrnuqhjx-wifiacmtsa-n
1 oare namme foar dizze substansje
5'-o- [bis (4-methovyPhenyl) fenylmethyl] -2'-o-methyl-n- (2-metyl-1-oxoprop) guanosine (aci)
| Eigenskippen beskikber |
| Biologysk |
| Gemysk |
| Densheid |
| Lipinski |
| Struktuer relatearre |
Biologysk
| Besit | Wearde | Betingst | Boarne |
| Bioconcentration Factor | 797 | pH 1; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 2030 | pH 2; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 2400 | pH 3; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 2450 | pH 4; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 2450 | pH 5; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 2450 | pH 6; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 2420 | pH 7; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 2170 | pH 8; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 1070 | pH 9; Temp: 25 ° C | (1) ACD |
| Bioconcentration Factor | 195 | 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 | 3020 | pH 1; Temp: 25 ° C | (1) ACD |
| Koc | 7680 | pH 2; Temp: 25 ° C | (1) ACD |
| Koc | 9100 | pH 3; Temp: 25 ° C | (1) ACD |
| Koc | 9270 | pH 4; Temp: 25 ° C | (1) ACD |
| Koc | 9290 | pH 5; Temp: 25 ° C | (1) ACD |
| Koc | 9280 | pH 6; Temp: 25 ° C | (1) ACD |
| Koc | 9170 | pH 7; Temp: 25 ° C | (1) ACD |
| Koc | 8220 | pH 8; Temp: 25 ° C | (1) ACD |
| Koc | 4050 | pH 9; Temp: 25 ° C | (1) ACD |
| Koc | 737 | pH 10; Temp: 25 ° C | (1) ACD |
| Logd | 4.27 | pH 1; Temp: 25 ° C | (1) ACD |
| Logd | 4.68 | pH 2; Temp: 25 ° C | (1) ACD |
| Besit | Wearde | Betingst | Boarne |
| Logd | 4.75 | pH 3; Temp: 25 ° C | (1) ACD |
| Logd | 4.76 | pH 4; Temp: 25 ° C | (1) ACD |
| Logd | 4.76 | pH 5; Temp: 25 ° C | (1) ACD |
| Logd | 4.76 | pH 6; Temp: 25 ° C | (1) ACD |
| Logd | 4.76 | pH 7; Temp: 25 ° C | (1) ACD |
| Logd | 4.71 | pH 8; Temp: 25 ° C | (1) ACD |
| Logd | 4,40 | pH 9; Temp: 25 ° C | (1) ACD |
| Logd | 3.66 | pH 10; Temp: 25 ° C | (1) ACD |
| Logp | 4,763 ± 0.722 | Temp: 25 ° C | (1) ACD |
| Massa intrinsike oplosmiddel | 3.1 x 10-4 g / l | Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 9,4 x 10-4 g / l | pH 1; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3,7 x 10-4 g / l | pH 2; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.1 x 10-4 g / l | pH 3; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.1 x 10-4 g / l | pH 4; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.1 x 10-4 g / l | pH 5; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.1 x 10-4 g / l | pH 6; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.1 x 10-4 g / l | pH 7; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3,5 x 10-4 g / l | pH 8; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 7,4 x 10-4 g / l | pH 9; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3,9 x 10-3 g / l | pH 10; Temp: 25 ° C | (1) ACD |
| Massa-oplosberens | 3.1 x 10-4 g / l | Unbuffered water phel 6; Temp: 25 ° C | (1) ACD |
| Molêre yntrinsike oplosmiddel | 4.6 x 10-7 Mol / L | Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 1,4 x 10-6 Mol / L | pH 1; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 5,5 x 10-7 Mol / L | pH 2; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 4,7 x 10-7 Mol / L | pH 3; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 4.6 x 10-7 Mol / L | pH 4; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 4.6 x 10-7 Mol / L | pH 5; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 4.6 x 10-7 Mol / L | pH 6; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 4.6 x 10-7 Mol / L | pH 7; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 5,2 x 10-7 Mol / L | pH 8; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 1.1 X 10-6 Mol / L | pH 9; Temp: 25 ° C | (1) ACD |
| Milarlabiliteit | 5,8 x 10-6 Mol / L | pH 10; Temp: 25 ° C | (1) ACD |
| Besit | Wearde | Betingst | Boarne |
| Milarlabiliteit | 4.6 x 10-7 Mol / L | Unbuffered water phel 6; Temp: 25 ° C | (1) ACD |
| Molekulêr gewicht | 669.72 | ||
| pka | 9,16 ± 0.20 | Meast Acidic Temp: 25 ° C | (1) ACD |
| pka | 1.73 ± 0.10 | Meast basic 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 | 1,35 ± 0,1 g / cm3 | Temp: 20 ° C; Parse: 760 Torr | (1) ACD |
| Molar volume | 494.4 ± 7,0 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 | 12 | (1) ACD | |
| H akseptearders | 13 | (1) ACD | |
| H Donors | 3 | (1) ACD | |
| H Donor / akseptearje SUM | 16 | (1) ACD | |
| Logp | 4,763 ± 0.722 | Temp: 25 ° C | (1) ACD |
| Molekulêr gewicht | 669.72 |
(1) Berekkene mei avansearre Chemy Untwikkeling (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)
Struktuer relatearre
| Besit | Wearde | Betingst | Boarne |
| Polar oerflak | 155 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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