![C41H39NO6 1 Aigéad PyrrolidineCarboxylic, 2-[[Bis (4-Methoxyphenyl) Phenylm Ethoxy] meitil] -4-hiodroxy-, 9H-fluoren-9-ylmethyl eistir, (2s, 4r)-(9 CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C41H39NO6 1 Aigéad PyrrolidineCarboxylic, 2-[[Bis (4-Methoxyphenyl) Phenylm Ethoxy] meitil] -4-hiodroxy-, 9H-fluoren-9-y-ylmethyl eistir, (2s, 4r)-(9 CI, ACI) Íomhá le feiceáil](https://cdn.globalso.com/nvchem/C41H39NO6-1-Pyrrolidinecarboxylic-acid.jpg)
C41H39NO6 1 Aigéad PyrrolidineCarboxylic, 2-[[Bis (4-Methoxyphenyl) Phenylm Ethoxy] meitil] -4-hiodroxy-, 9H-fluoren-9-ylmethyl eistir, (2s, 4r)-(9 CI, ACI)
| Príomh -airíonna fisiceacha | Luach | Coinníollacha a chur le |
| Meáchan móilíneach | 641.75 | - |
| Fiuchphointe (tuartha) | 768.7 ± 60.0 ° C. | Brúigh: 760 Torr |
| Dlús (tuartha) | 1.237 ± 0.06 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr |
| PKA (tuartha) | 14.50 ± 0.40 | An luas is aigéid: 25 ° C. |
Smiles canóracha o = C (occ1c = 2c = cc = cc2c = 3c = cc = cc31) n4cc (o) cc4coc (c = 5c = cc = cc5) (c6 = cc = c (oc) c = c6) c7 = cc = c (oc) C = C7
Smiles isiméireacha C (OC [C@H] 1n (C (OCC2C = 3C (C = 4C2 = CC = CC4) = CC = CC3) = O) C [C@H] (O) C1) (C5 = CC = C (OC) C = C5) (C6 = CC = C (OC) C = C6) C7 = CC = CC = C7
Orlach
Inchi = 1S/C41H39NO6/C1-45-33-20-16-29 (17-21-33) 41 (28-10-4-3-5-11-28,30-18-22-34 (46-2) 23-19-30) 48-26-31-24-32 (43) 25-42 (31) 40 ( 44) 47-27-39-37-14-8-6-12-35 (37) 36-13-7-9-15-38 (36) 39/H3-23,31-32,39,43H, 24-27H2,1-2H3/T31-, 32+/M0/S1
Eochair Inchi
Qpxskgjqebdwes -jqtzopksa-n
2 ainm eile don tsubstaint seo
Aigéad 1-pyrrolidinecarboxylic, 2-[[bis (4-methoxyphenyl) phenylmethoxy] meitil] -4-hiodrocsa, 9H-fluoren-9-ylmethyl eistir, (2S-Trans)-(ZCI); 9H-Fluoren-9-ylmethyl (2s, 4r) -2-[[bis (4-methoxyphenyl) feinilmethoxy] meitil] -4-hydroxy-1-pyrrolidinecarboxylate (ACI) (ACI).
| Airíonna atá ar fáil |
| Bitheolaíoch |
| Ceimiceán |
| Dlús |
| Lipinski |
| A bhaineann le struchtúr |
| Teirmeach |
Bitheolaíoch
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Fachtóir bith -chomhchruinnithe | 1.00 x 106 | pH 1; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.00 x 106 | pH 2; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.00 x 106 | pH 3; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.00 x 106 | pH 4; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.00 x 106 | pH 5; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.00 x 106 | pH 6; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.00 x 106 | pH 7; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.00 x 106 | pH 8; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.00 x 106 | pH 9; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1.00 x 106 | pH 10; TEMP: 25 ° C. | (1) ACD |
.
Ceimiceán
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| KOC | 7.70 x 105 | pH 1; TEMP: 25 ° C. | (1) ACD |
| KOC | 7.70 x 105 | pH 2; TEMP: 25 ° C. | (1) ACD |
| KOC | 7.70 x 105 | pH 3; TEMP: 25 ° C. | (1) ACD |
| KOC | 7.70 x 105 | pH 4; TEMP: 25 ° C. | (1) ACD |
| KOC | 7.70 x 105 | pH 5; TEMP: 25 ° C. | (1) ACD |
| KOC | 7.70 x 105 | pH 6; TEMP: 25 ° C. | (1) ACD |
| KOC | 7.70 x 105 | pH 7; TEMP: 25 ° C. | (1) ACD |
| KOC | 7.70 x 105 | pH 8; TEMP: 25 ° C. | (1) ACD |
| KOC | 7.70 x 105 | pH 9; TEMP: 25 ° C. | (1) ACD |
| KOC | 7.70 x 105 | pH 10; TEMP: 25 ° C. | (1) ACD |
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| logáil | 8.29 | pH 1; TEMP: 25 ° C. | (1) ACD |
| logáil | 8.29 | pH 2; TEMP: 25 ° C. | (1) ACD |
| logáil | 8.29 | pH 3; TEMP: 25 ° C. | (1) ACD |
| logáil | 8.29 | pH 4; TEMP: 25 ° C. | (1) ACD |
| logáil | 8.29 | pH 5; TEMP: 25 ° C. | (1) ACD |
| logáil | 8.29 | pH 6; TEMP: 25 ° C. | (1) ACD |
| logáil | 8.29 | pH 7; TEMP: 25 ° C. | (1) ACD |
| logáil | 8.29 | pH 8; TEMP: 25 ° C. | (1) ACD |
| logáil | 8.29 | pH 9; TEMP: 25 ° C. | (1) ACD |
| logáil | 8.29 | pH 10; TEMP: 25 ° C. | (1) ACD |
| logáil | 8.289 ± 0.729 | TEMP: 25 ° C. | (1) ACD |
| Aifreann Intreach intreach | 4.7 x 10-6 g/l | TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.7 x 10-6 g/l | pH 1; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.7 x 10-6 g/l | pH 2; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.7 x 10-6 g/l | pH 3; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.7 x 10-6 g/l | pH 4; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.7 x 10-6 g/l | pH 5; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.7 x 10-6 g/l | pH 6; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.7 x 10-6 g/l | pH 7; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.7 x 10-6 g/l | pH 8; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.7 x 10-6 g/l | pH 9; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.7 x 10-6 g/l | pH 10; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 4.7 x 10-6 g/l | Uisce neamh -mhaolaithe pH 7.00; TEMP: 25 ° C. | (1) ACD |
| Intuaslagthacht intreach molar | 7.3 x 10-9 mol/l | TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.3 x 10-9 mol/l | pH 1; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.3 x 10-9 mol/l | pH 2; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.3 x 10-9 mol/l | pH 3; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.3 x 10-9 mol/l | pH 4; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.3 x 10-9 mol/l | pH 5; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.3 x 10-9 mol/l | pH 6; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.3 x 10-9 mol/l | pH 7; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.3 x 10-9 mol/l | pH 8; TEMP: 25 ° C. | (1) ACD |
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Tuaslagthacht molar | 7.3 x 10-9 mol/l | pH 9; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.3 x 10-9 mol/l | pH 10; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 7.3 x 10-9 mol/l | Uisce neamh -mhaolaithe pH 7.00; TEMP: 25 ° C. | (1) ACD |
| Meáchan móilíneach | 641.75 | ||
| pka | 14.50 ± 0.40 | An luas is aigéid: 25 ° C. | (1) ACD |
| pka | -3.24 ± 0.60 | An luas is bunúsaí: 25 ° C. | (1) ACD |
| Brú gaile | 7.42 x 10-25 Torr | TEMP: 25 ° C. | (1) ACD |
.
Dlús
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Dlús | 1.237 ± 0.06 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
| Toirt molar | 518.4 ± 3.0 cm3/mol | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
.
Lipinski
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Bannaí rotatable faoi shaoirse | 12 | (1) ACD | |
| H Glacadóirí | 7 | (1) ACD | |
| Hontóirí H. | 1 | (1) ACD | |
| H suim deontóra/glacadóir | 8 | (1) ACD | |
| logáil | 8.289 ± 0.729 | TEMP: 25 ° C. | (1) ACD |
| Meáchan móilíneach | 641.75 |
.
A bhaineann le struchtúr
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Achar dromchla polar | 77.5 A2 | (1) ACD | |
.
Teirmeach
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Fiuchphointe | 768.7 ± 60.0 ° C. | Brúigh: 760 Torr | (1) ACD |
| Eantalpacht an ghalraithe | 117.42 ± 3.0 kJ/mol | Brúigh: 760 Torr | (1) ACD |
| Bonnphointe | 418.7 ± 32.9 ° C. | (1) ACD |
.
Speictrim ar fáil
1H NMR
13c NMR
Scríobh do theachtaireacht anseo agus seol chugainn é
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