C42H39N3O8 nár sannadh fós
Príomh -airíonna fisiceacha | Luach | Coinníollacha a chur le |
Meáchan móilíneach | 713.78 | - |
Dlús (tuartha) | 1.315 ± 0.06 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr |
PKA (tuartha) | 8.23 ± 0.10 | An luas is aigéid: 25 ° C. |
Smiles canóracha O = C1NC (= O) N (C = C1C (= O) NCC2 = CC = CC = CC = CC = CC32) C4OC (COC (C = 5C = CC = CC5) (C6 = CC = C (OC) C = C6) C7 = CC = C (OC) C = C7) C (O) C4)
Smiles isiméireach
C (OC [c@h] 1o [c@h] (c [c @@ h] 1o) n2c = c (c (ncc = 3c4 = c (c = cc3) c = cc = c4) = o) c (= o) nc2 = o) (c5 = c = c (oc) c = c = c = c = c = c = c = c = c = c = c = c = c = c = c = c (
Orlach
Inchi = 1S/C42H39N3O8/C1-50-32-19-15-30 (16-20-32) 42 (29-12-4-3-5-13-29,31-17-21-33 (51-2) 22-18-31) 52-26-37-36 (46) 23-38 (53-37) 4 5-25-35 (40 (48) 44-41 (45) 49) 39 (47) 43-24-28-11-8-10-27-9-6-7-14-34 (27) 28/H3-22,25,36-38,46H, 23-24,26H2,1-2H3, (h, 43,47) (H, 44,48,49)/T36-, 37+, 38+/M0/S1
Eochair Inchi
Hdumrqqryjobfs-yxwiycfasa-n
Airíonna atá ar fáil |
Bitheolaíoch |
Airíonna atá ar fáil |
Ceimiceán |
Dlús |
Lipinski |
A bhaineann le struchtúr |
Bitheolaíoch
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Fachtóir bith -chomhchruinnithe | 41700 | pH 1; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 41700 | pH 2; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 41700 | pH 3; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 41700 | pH 4; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 41700 | pH 5; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 41200 | pH 6; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 36900 | pH 7; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 18100 | pH 8; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 3290 | pH 9; TEMP: 25 ° C. | (1) ACD |
Fachtóir bith -chomhchruinnithe | 718 | pH 10; TEMP: 25 ° C. | (1) ACD |
.
Ceimiceán
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
KOC | 70600 | pH 1; TEMP: 25 ° C. | (1) ACD |
KOC | 70600 | pH 2; TEMP: 25 ° C. | (1) ACD |
KOC | 70600 | pH 3; TEMP: 25 ° C. | (1) ACD |
KOC | 70600 | pH 4; TEMP: 25 ° C. | (1) ACD |
KOC | 70500 | pH 5; TEMP: 25 ° C. | (1) ACD |
KOC | 69700 | pH 6; TEMP: 25 ° C. | (1) ACD |
KOC | 62400 | pH 7; TEMP: 25 ° C. | (1) ACD |
KOC | 30600 | pH 8; TEMP: 25 ° C. | (1) ACD |
KOC | 5560 | pH 9; TEMP: 25 ° C. | (1) ACD |
KOC | 1210 | pH 10; TEMP: 25 ° C. | (1) ACD |
logáil | 6.38 | pH 1; TEMP: 25 ° C. | (1) ACD |
logáil | 6.38 | pH 2; TEMP: 25 ° C. | (1) ACD |
logáil | 6.38 | pH 3; TEMP: 25 ° C. | (1) ACD |
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
logáil | 6.38 | pH 4; TEMP: 25 ° C. | (1) ACD |
logáil | 6.38 | pH 5; TEMP: 25 ° C. | (1) ACD |
logáil | 6.38 | pH 6; TEMP: 25 ° C. | (1) ACD |
logáil | 6.33 | pH 7; TEMP: 25 ° C. | (1) ACD |
logáil | 6.02 | pH 8; TEMP: 25 ° C. | (1) ACD |
logáil | 5.28 | pH 9; TEMP: 25 ° C. | (1) ACD |
logáil | 4.62 | pH 10; TEMP: 25 ° C. | (1) ACD |
logáil | 6.382 ± 0.644 | TEMP: 25 ° C. | (1) ACD |
Aifreann Intreach intreach | 5.1 x 10-7 g/l | TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.1 x 10-7 g/l | pH 1; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.1 x 10-7 g/l | pH 2; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.1 x 10-7 g/l | pH 3; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.1 x 10-7 g/l | pH 4; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.1 x 10-7 g/l | pH 5; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.1 x 10-7 g/l | pH 6; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.7 x 10-7 g/l | pH 7; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 1.1 x 10-6 g/l | pH 8; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 6.4 x 10-6 g/l | pH 9; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 2.9 x 10-5 g/l | pH 10; TEMP: 25 ° C. | (1) ACD |
Aifreann tuaslagthachta | 5.7 x 10-7 g/l | Uisce neamh -mhaolaithe pH 7.00; TEMP: 25 ° C. | (1) ACD |
Intuaslagthacht intreach molar | 7.1 x 10-10 mol/l | TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 7.1 x 10-10 mol/l | pH 1; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 7.1 x 10-10 mol/l | pH 2; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 7.1 x 10-10 mol/l | pH 3; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 7.1 x 10-10 mol/l | pH 4; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 7.1 x 10-10 mol/l | pH 5; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 7.2 x 10-10 mol/l | pH 6; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 8.0 x 10-10 mol/l | pH 7; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 1.6 x 10-9 mol/l | pH 8; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 9.0 x 10-9 mol/l | pH 9; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 4.1 x 10-8 mol/l | pH 10; TEMP: 25 ° C. | (1) ACD |
Tuaslagthacht molar | 8.0 x 10-10 mol/l | Uisce neamh -mhaolaithe pH 7.00; TEMP: 25 ° C. | (1) ACD |
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Meáchan móilíneach | 713.78 | ||
pka | 8.23 ± 0.10 | An luas is aigéid: 25 ° C. | (1) ACD |
pka | -1.90 ± 0.20 | An luas is bunúsaí: 25 ° C. | (1) ACD |
.
Dlús
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Dlús | 1.315 ± 0.06 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
Toirt molar | 542.7 ± 3.0 cm3/mol | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
.
Lipinski
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Bannaí rotatable faoi shaoirse | 13 | (1) ACD | |
H Glacadóirí | 11 | (1) ACD | |
Hontóirí H. | 3 | (1) ACD | |
H suim deontóra/glacadóir | 14 | (1) ACD | |
logáil | 6.382 ± 0.644 | TEMP: 25 ° C. | (1) ACD |
Meáchan móilíneach | 713.78 |
.
A bhaineann le struchtúr
Maoin | Luach | Coinníollacha a chur le | Aimsigh |
Achar dromchla polar | 136 A2 | (1) ACD |
.
Speictrim ar fáil
1H NMR
13c NMR