C20H23N5O6 adenosine, N-Benzoyl-2′-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-oth.
Príomh -airíonna fisiceacha | Luach | Coinníollacha a chur le |
Meáchan móilíneach | 429.43 | - |
Dlús (tuartha) | 1.53 ± 0.1 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr |
PKA (tuartha) | 13.15 ± 0.70 | An luas is aigéid: 25 ° C. |
Smiles Canónach O = C (NC1 = NC = NC2 = C1N = CN2C3OC (CO) C (O) C3OCCOC) C = 4C = CC = CC4
Smiles isiméireacha O (CCOC) [C@H] 1 [C @@ H] (O [C@H] (CO) [C@H] 1O) N2C = 3C (n = C2) = C (NC (= O) C4 = CC = CC = C4) N = CN3
Orlach
Inchi = 1S/C20H23N5O6/C1-29-7-8-30-16-15 (27) 13 (9-26) 31-20 (16) 25-11-23-14-17 (21-10-22-18 (14) 25) 24-19 (28) 12-5-3-2-4-6-12/H2-6,1 .
Eochair Inchi
Rufjmcsvnngzfb-khtyjdqrsa-n
2 ainm eile don tsubstaint seo
Adenosine N-Benzoyl-2'-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-o-oth; N6-Benzoyl-2′-O-(2-methoxyethyl)adenosine
Speictrim ar fáil
1H NMR
13c NMR
Airíonna atá ar fáil |
Bitheolaíoch |
Ceimiceán |
Dlús |
Lipinski |
A bhaineann le struchtúr |
Bitheolaíoch
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Fachtóir bith -chomhchruinnithe | 3.71 | pH 1; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 14.6 | pH 2; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 20.9 | pH 3; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 21.8 | pH 4; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 21.9 | pH 5; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 21.8 | pH 6; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 21.4 | pH 7; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 17.6 | pH 8; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 6.52 | pH 9; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 1.08 | pH 10; TEMP: 25 ° C. | (1) ACD |
.
Ceimiceán
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
KOC | 53.2 | pH 1; TEMP: 25 ° C. | (1) ACD |
KOC | 210 | pH 2; TEMP: 25 ° C. | (1) ACD |
KOC | 299 | pH 3; TEMP: 25 ° C. | (1) ACD |
KOC | 312 | pH 4; TEMP: 25 ° C. | (1) ACD |
KOC | 314 | pH 5; TEMP: 25 ° C. | (1) ACD |
KOC | 313 | pH 6; TEMP: 25 ° C. | (1) ACD |
KOC | 306 | pH 7; TEMP: 25 ° C. | (1) ACD |
KOC | 253 | pH 8; TEMP: 25 ° C. | (1) ACD |
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
KOC | 93.5 | pH 9; TEMP: 25 ° C. | (1) ACD |
KOC | 15.5 | pH 10; TEMP: 25 ° C. | (1) ACD |
logáil | 1.30 | pH 1; TEMP: 25 ° C. | (1) ACD |
logáil | 1.90 | pH 2; TEMP: 25 ° C. | (1) ACD |
logáil | 2.05 | pH 3; TEMP: 25 ° C. | (1) ACD |
logáil | 2.07 | pH 4; TEMP: 25 ° C. | (1) ACD |
logáil | 2.07 | pH 5; TEMP: 25 ° C. | (1) ACD |
logáil | 2.07 | pH 6; TEMP: 25 ° C. | (1) ACD |
logáil | 2.06 | pH 7; TEMP: 25 ° C. | (1) ACD |
logáil | 1.98 | pH 8; TEMP: 25 ° C. | (1) ACD |
logáil | 1.54 | pH 9; TEMP: 25 ° C. | (1) ACD |
logáil | 0.76 | pH 10; TEMP: 25 ° C. | (1) ACD |
logáil | 2.085 ± 0.689 | TEMP: 25 ° C. | (1) ACD |
Aifreann Intreach intreach | 0.030 g/L. | TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.17 g/L. | pH 1; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.0429 g/L. | pH 2; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.030 g/L. | pH 3; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.029 g/L. | pH 4; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.029 g/L. | pH 5; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.029 g/L. | pH 6; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.029 g/L. | pH 7; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.036 g/L. | pH 8; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.094 g/l | pH 9; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.60 g/L. | pH 10; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 0.029 g/L. | Uisce neamh -mhaolaithe pH 6.38; TEMP: 25 ° C. | (1) ACD |
Intuaslagthacht intreach molar | 7.0 x 10-5 mol/l | TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 3.9 x 10-4 mol/l | pH 1; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 1.00 x 10-4 mol/l | pH 2; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 7.0 x 10-5 mol/l | pH 3; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 6.7 x 10-5 mol/l | pH 4; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 6.7 x 10-5 mol/l | pH 5; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 6.7 x 10-5 mol/l | pH 6; TEMP: 25 ° C. | (1) ACD |
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Tuaslagthacht molar | 6.8 x 10-5 mol/l | pH 7; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 8.3 x 10-5 mol/l | pH 8; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 2.2 x 10-4 mol/l | pH 9; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 1.4 x 10-3 mol/l | pH 10; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 6.7 x 10-5 mol/l | Uisce neamh -mhaolaithe pH 6.38; TEMP: 25 ° C. | (1) ACD |
Meáchan móilíneach | 429.43 | ||
pka | 13.15 ± 0.70 | An luas is aigéid: 25 ° C. | (1) ACD |
pka | 8.80 ± 0.10 | An luas is bunúsaí: 25 ° C. | (1) ACD |
.
Dlús
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Dlús | 1.53 ± 0.1 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
Toirt molar | 280.3 ± 7.0 cm3/mol | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
.
Lipinski
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Bannaí rotatable faoi shaoirse | 9 | (1) ACD | |
H Glacadóirí | 11 | (1) ACD | |
Hontóirí H. | 3 | (1) ACD | |
H suim deontóra/glacadóir | 14 | (1) ACD | |
logáil | 2.085 ± 0.689 | TEMP: 25 ° C. | (1) ACD |
Meáchan móilíneach | 429.43 |
.
A bhaineann le struchtúr
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Achar dromchla polar | 141 A2 | (1) ACD |
.
Speictrim ar fáil
1H NMR
13c NMR
Scríobh do theachtaireacht anseo agus seol chugainn é