C43H55N4O10P uridine, 5 '- [MethOxyPhenyl) fenylmethyl] -2' "-MethOl-Tyl) - 5-METHYTHYL N, N-BIS (1-METHYLETHYL) foshor amidite] (aci)

produkt

C43H55N4O10P uridine, 5 '- [MethOxyPhenyl) fenylmethyl] -2' "-MethOl-Tyl) - 5-METHYTHYL N, N-BIS (1-METHYLETHYL) foshor amidite] (aci)

Basisynformaasje:


Produkt detail

Produkt tags

Substânsje detail

CAS Registry Number

163878-63-5

H302

Kaai fysike eigenskippen Wearde Betingst
Molekulêr gewicht 818.89 -
PKA (foarsizze) 9.55 ± 0.10 Meast Acidic Temp: 25 ° C

Oare nammen en identifisearders

Kanonyske glimkes

N # cccop (oc1c (oc (n2c = c (c (= o) nc2 = c) c) c) c = cc = c = c (cv = c = c (c5) n (c (c (c) c) c (c (c (c (c) c) c (c (c) c)

Isomeryske glimkes

C (oc [c @@ h] 1 [c @@ h] (op (c (c (c (c (c) c) occ) [c @) c (= c) c (c3 = c (cc = c (oc) c = c = c (c4 = cc = C (oc) c = c4) c5 = cc = cc = c5

Inchi

Inchi = 1s / c43h55n4o10p / c1-29 (2) 47 (30 (3) 4) 58 (55-23/31) 57-38-37 (56-23-35-50 (5) 40 (48) 45-42 (46) 49) 2 8-54-43(32-13-10-9-11-14-32,33-15-19-35(51-7)20-16-33)34-17-21-36(52-8)22-18-34/h9-11,13-22,27,29-30,37-39,41H,12,24-26,28H2, 1-8h3, (H, 45.48,49) / T37-, 38-, 39-, 41-, 58? / M1 / ​​S1

Inchi-kaai

Yfrrkzdudxhjnc-kzqaaKllsa-n

17 oare nammen foar dizze substansje

Uridine, 5 '-O- [bis (4-methovyPhenyl) fenylmethyl] -2 '-O- (2-Methoxyethyl) - 5-methyl-, 3 '- [2-Cyanethyl bis (1-methylethyl) fosfor

amidite] (9ci); 10: PN: US20030212017 Side: 18 opeaske RNA; 11: PN: US20030211606 Side: 18 opeaske RNA; 13: PN: US20040

005569 pagina: 21 opeaske RNA; 13: Pn: US20040006030 Side: 22 opeaske RNA; 13: pn: US20040014048 Side: 19 opeaske rna; 13: pn: US20040014049 Side: 19 opeaske RNA; 14: PN: US20030198965 Side: 19 opeaske RNA; 14: PN: US20040005565-pagina: 17- 22 opeaske rna; 14: PN: US20040005570 Side: 19 opeaske RNA; 14: PN: US20040014047 Side: 19 opeaske RNA; 14: PN: US20040

014699 Side: 19 opeaske RNA; 15: PN: US20040014050 Side: 19 opeaske RNA; 15: PN: US20040014051 Side: 21 opeaske RNA; 15:

PN: Wo03106645 Page: 69 opeaske RNA; 16: PN: US20040006029 pagina: 22 opeaske RNA; 87: PN: US20040005707 Side: 19 opeaske RNA

Eksperimintele spektra

Spectra te krijen
1 h nmr
13 C NMR
Hetero nmr

Foarsichtich eigenskippen

Eigenskippen beskikber
Biologysk
Gemysk
Lipinski
Struktuer relatearre

Biologysk

Besit Wearde Betingst Boarne
Bioconcentration Factor 348 pH 1; Temp: 25 ° C (1) ACD
Bioconcentration Factor 2810 pH 2; Temp: 25 ° C (1) ACD
Bioconcentration Factor 21100 pH 3; Temp: 25 ° C (1) ACD
Bioconcentration Factor 63100 pH 4; Temp: 25 ° C (1) ACD
Bioconcentration Factor 78800 pH 5; Temp: 25 ° C (1) ACD
Bioconcentration Factor 80800 pH 6; Temp: 25 ° C (1) ACD
Bioconcentration Factor 80800 pH 7; Temp: 25 ° C (1) ACD
Bioconcentration Factor 78800 pH 8; Temp: 25 ° C (1) ACD
Bioconcentration Factor 63400 pH 9; Temp: 25 ° C (1) ACD
Bioconcentration Factor 21800 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 487 pH 1; Temp: 25 ° C (1) ACD
Koc 3940 pH 2; Temp: 25 ° C (1) ACD
Koc 29600 pH 3; Temp: 25 ° C (1) ACD
Koc 88400 pH 4; Temp: 25 ° C (1) ACD

 

Besit Wearde Betingst Boarne
Koc 1.10 x 105 pH 5; Temp: 25 ° C (1) ACD
Koc 1.13 x 105 pH 6; Temp: 25 ° C (1) ACD
Koc 1.13 x 105 pH 7; Temp: 25 ° C (1) ACD
Koc 1.10 x 105 pH 8; Temp: 25 ° C (1) ACD
Koc 88800 pH 9; Temp: 25 ° C (1) ACD
Koc 30600 pH 10; Temp: 25 ° C (1) ACD
Logd 4.39 pH 1; Temp: 25 ° C (1) ACD
Logd 5.30 oere pH 2; Temp: 25 ° C (1) ACD
Logd 6.18 pH 3; Temp: 25 ° C (1) ACD
Logd 6.65 pH 4; Temp: 25 ° C (1) ACD
Logd 6,75 pH 5; Temp: 25 ° C (1) ACD
Logd 6.76 pH 6; Temp: 25 ° C (1) ACD
Logd 6.76 pH 7; Temp: 25 ° C (1) ACD
Logd 6,75 pH 8; Temp: 25 ° C (1) ACD
Logd 6.65 pH 9; Temp: 25 ° C (1) ACD
Logd 6.19 pH 10; Temp: 25 ° C (1) ACD
Logp 6.761 ± 0.669 Temp: 25 ° C (1) ACD
Massa intrinsike oplosmiddel 2.0 x 10-4 g / l Temp: 25 ° C (1) ACD
Massa-oplosberens 0.046 g / l pH 1; Temp: 25 ° C (1) ACD
Massa-oplosberens 5,7 x 10-3 G / L pH 2; Temp: 25 ° C (1) ACD
Massa-oplosberens 7,6 x 10-4 g / l pH 3; Temp: 25 ° C (1) ACD
Massa-oplosberens 2,5 x 10-4 g / l pH 4; Temp: 25 ° C (1) ACD
Massa-oplosberens 2.0 x 10-4 g / l pH 5; Temp: 25 ° C (1) ACD
Massa-oplosberens 2.0 x 10-4 g / l pH 6; Temp: 25 ° C (1) ACD
Massa-oplosberens 2.0 x 10-4 g / l pH 7; Temp: 25 ° C (1) ACD
Massa-oplosberens 2.0 x 10-4 g / l pH 8; Temp: 25 ° C (1) ACD
Massa-oplosberens 2,5 x 10-4 g / l pH 9; Temp: 25 ° C (1) ACD
Massa-oplosberens 7,4 x 10-4 g / l pH 10; Temp: 25 ° C (1) ACD
Massa-oplosberens 2.0 x 10-4 g / l Unbuffered wetter Ph 7.00; Temp: 25 ° C (1) ACD
Molêre yntrinsike oplosmiddel 2,4 x 10-7 Mol / L Temp: 25 ° C (1) ACD
Milarlabiliteit 5,6 x 10-5 Mol / L pH 1; Temp: 25 ° C (1) ACD
Milarlabiliteit 7.0 x 10-6 Mol / L pH 2; Temp: 25 ° C (1) ACD

 

Besit Wearde Betingst Boarne
Milarlabiliteit 9.3 x 10-7 mol / l pH 3; Temp: 25 ° C (1) ACD
Milarlabiliteit 3.1 x 10-7 Mol / L pH 4; Temp: 25 ° C (1) ACD
Milarlabiliteit 2,5 x 10-7 Mol / L pH 5; Temp: 25 ° C (1) ACD
Milarlabiliteit 2,4 x 10-7 Mol / L pH 6; Temp: 25 ° C (1) ACD
Milarlabiliteit 2,4 x 10-7 Mol / L pH 7; Temp: 25 ° C (1) ACD
Milarlabiliteit 2,5 x 10-7 Mol / L pH 8; Temp: 25 ° C (1) ACD
Milarlabiliteit 3.1 x 10-7 Mol / L pH 9; Temp: 25 ° C (1) ACD
Milarlabiliteit 9.0 x 10-7 Mol / L pH 10; Temp: 25 ° C (1) ACD
Milarlabiliteit 2,4 x 10-7 Mol / L Unbuffered wetter Ph 7.00; Temp: 25 ° C (1) ACD
Molekulêr gewicht 818.89    
pka 9.55 ± 0.10 Meast Acidic Temp: 25 ° C (1) ACD
pka 3.45 ± 0,70 Meast basic temp: 25 ° C (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 21   (1) ACD
H akseptearders 14   (1) ACD
H Donors 1   (1) ACD
H Donor / akseptearje SUM 15   (1) ACD
Logp 6.761 ± 0.669 Temp: 25 ° C (1) ACD
Molekulêr gewicht 818.89    

(1) Berekkene mei avansearre Chemy Untwikkeling (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)

Struktuer relatearre

Besit Wearde Betingst boarne
Polar oerflak 164 a2 (1) ACD

(1) Berekkene mei avansearre Chemy Untwikkeling (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)

Foarseine spektra

Spectra te krijen
1 h nmr
13 C NMR

GHS-gefaarferklearring

Koade gefaarferklearring boarne
H302 skealik as it swalke European Chemical Agency (Echa) Klassifikaasje en etikettering

Ynventarisaasje - notified Classification and label - Meast Common notifikaasjes, European Chemical Agency (Echa)

Klassifikaasje- en etikettering ynventarisaasje - notified klassifikaasje en etikettering - meast serieuze notifikaasjes


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