![C38H49NO7 1- Aigéad pyrrolidinedodecanoic, 2- [[bis (4-methoxyphenyl) phenylm eitile] meitil] -4-hiodrocsa-λ-oxo- (2S, 4r)-(ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C38H49NO7 1- Aigéad pyrrolidinedodecanoic, 2- [[bis (4-methoxyphenyl) phenylm eitile] meitil] -4-hydroxy-λ-oxo- (2S, 4r)-(ACI) íomhá le feiceáil](https://cdn.globalso.com/nvchem/C38H49NO7-1-Pyrrolidinedodecanoic-acid.jpg)
C38H49NO7 1- Aigéad pyrrolidinedodecanoic, 2- [[bis (4-methoxyphenyl) phenylm eitile] meitil] -4-hiodrocsa-λ-oxo- (2S, 4r)-(ACI)
| Príomh -airíonna fisiceacha | Luach | Coinníollacha a chur le |
| Meáchan móilíneach | 631.80 | - |
| Fiuchphointe (tuartha) | 779.4 ± 60.0 ° C. | Brúigh: 760 Torr |
| Dlús (tuartha) | 1.154 ± 0.06 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr |
| PKA (tuartha) | 4.78 ± 0.10 | An luas is aigéid: 25 ° C. |
Smiles Canónach O = C (O) CCCCCCCCCCC (= O) N1CC (O) CC1COC (C = 2C = CC = CC2) (C3 = CC = C (OC) C = C3) C4 = CC = C (OC) C = C4
Smiles isiméireach C (OC [C@H] 1n (C (CCCCCCCCCCC (O) = O) = O) C [C@H] (O) C1) (C2 = CC = C (OC) C = C2) (C3 = CC = C (OC) C = C3) C4 = CC = CC = C4
Orlach
Inchi = 1S/C38H49NO7/C1-44-34-22-18-30 (19-23-34) 38 (29-14-10-9-11-15-29,31-20-24-35 (45-2) 25-21-31) 46-28-32-26-33 (40) 27-39 (32) 36 (41) 16-12-7-5-3-4-6-8-8-13-17-37 (42) 43/H9-11,14-15,18-25,32-33,40H, 3-8,12-13,16-17,26-28H2,1-2H3, (H, 42,43)/T32-, 33+M0/S1, (H, 42,43)/T32-, 33+M0/S1
Eochair Inchi
Ceyltmdxadtbel-jhousysjsa-n
1 ainm eile ar an tsubstaint seo
.
| Airíonna atá ar fáil |
| Bitheolaíoch |
| Ceimiceán |
| Dlús |
| Lipinski |
| A bhaineann le struchtúr |
| Teirmeach |
Bitheolaíoch
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Fachtóir bith -chomhchruinnithe | 2.46 x 105 | pH 1; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 2.46 x 105 | pH 2; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 2.42 x 105 | pH 3; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 2.11 x 105 | pH 4; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 92400 | pH 5; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 14000 | pH 6; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 1510 | pH 7; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 192 | pH 8; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 58.6 | pH 9; TEMP: 25 ° C. | (1) ACD |
| Fachtóir bith -chomhchruinnithe | 45.3 | pH 10; TEMP: 25 ° C. | (1) ACD |
.
Ceimiceán
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| KOC | 2.52 x 105 | pH 1; TEMP: 25 ° C. | (1) ACD |
| KOC | 2.51 x 105 | pH 2; TEMP: 25 ° C. | (1) ACD |
| KOC | 2.47 x 105 | pH 3; TEMP: 25 ° C. | (1) ACD |
| KOC | 2.16 x 105 | pH 4; TEMP: 25 ° C. | (1) ACD |
| KOC | 94500 | pH 5; TEMP: 25 ° C. | (1) ACD |
| KOC | 14300 | pH 6; TEMP: 25 ° C. | (1) ACD |
| KOC | 1550 | pH 7; TEMP: 25 ° C. | (1) ACD |
| KOC | 196 | pH 8; TEMP: 25 ° C. | (1) ACD |
| KOC | 59.9 | pH 9; TEMP: 25 ° C. | (1) ACD |
| KOC | 46.3 | pH 10; TEMP: 25 ° C. | (1) ACD |
| logáil | 7.40 | pH 1; TEMP: 25 ° C. | (1) ACD |
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| logáil | 7.40 | pH 2; TEMP: 25 ° C. | (1) ACD |
| logáil | 7.39 | pH 3; TEMP: 25 ° C. | (1) ACD |
| logáil | 7.33 | pH 4; TEMP: 25 ° C. | (1) ACD |
| logáil | 6.97 | pH 5; TEMP: 25 ° C. | (1) ACD |
| logáil | 6.15 | pH 6; TEMP: 25 ° C. | (1) ACD |
| logáil | 5.19 | pH 7; TEMP: 25 ° C. | (1) ACD |
| logáil | 4.29 | pH 8; TEMP: 25 ° C. | (1) ACD |
| logáil | 3.77 | pH 9; TEMP: 25 ° C. | (1) ACD |
| logáil | 3.66 | pH 10; TEMP: 25 ° C. | (1) ACD |
| logáil | 7.397 ± 0.598 | TEMP: 25 ° C. | (1) ACD |
| Aifreann Intreach intreach | 1.3 x 10-4 g/l | TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 1.3 x 10-4 g/l | pH 1; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 1.3 x 10-4 g/l | pH 2; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 1.3 x 10-4 g/l | pH 3; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 1.5 x 10-4 g/l | pH 4; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 3.5 x 10-4 g/l | pH 5; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 2.3 x 10-3 g/l | pH 6; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 0.021 g/L. | pH 7; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 0.17 g/L. | pH 8; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 0.55 g/L. | pH 9; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 0.69 g/L. | pH 10; TEMP: 25 ° C. | (1) ACD |
| Aifreann tuaslagthachta | 1.3 x 10-3 g/l | Uisce neamh -mhaolaithe pH 5.73; TEMP: 25 ° C. | (1) ACD |
| Intuaslagthacht intreach molar | 2.1 x 10-7 mol/l | TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 2.1 x 10-7 mol/l | pH 1; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 2.1 x 10-7 mol/l | pH 2; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 2.1 x 10-7 mol/l | pH 3; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 2.4 x 10-7 mol/l | pH 4; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 5.5 x 10-7 mol/l | pH 5; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 3.6 x 10-6 mol/l | pH 6; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 3.4 x 10-5 mol/l | pH 7; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 2.7 x 10-4 mol/l | pH 8; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 8.7 x 10-4 mol/l | pH 9; TEMP: 25 ° C. | (1) ACD |
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Tuaslagthacht molar | 1.1 x 10-3 mol/l | pH 10; TEMP: 25 ° C. | (1) ACD |
| Tuaslagthacht molar | 2.1 x 10-6 mol/l | Uisce neamh -mhaolaithe pH 5.73; TEMP: 25 ° C. | (1) ACD |
| Meáchan móilíneach | 631.80 | ||
| pka | 4.78 ± 0.10 | An luas is aigéid: 25 ° C. | (1) ACD |
| pka | -2.31 ± 0.60 | An luas is bunúsaí: 25 ° C. | (1) ACD |
| Brú gaile | 1.42 x 10-25 Torr | TEMP: 25 ° C. | (1) ACD |
.
Dlús
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Dlús | 1.154 ± 0.06 g/cm3 | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
| Toirt molar | 547.3 ± 3.0 cm3/mol | TEMP: 20 ° C; Brúigh: 760 Torr | (1) ACD |
.
Lipinski
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Bannaí rotatable faoi shaoirse | 20 | (1) ACD | |
| H Glacadóirí | 8 | (1) ACD | |
| Hontóirí H. | 2 | (1) ACD | |
| H suim deontóra/glacadóir | 10 | (1) ACD | |
| logáil | 7.397 ± 0.598 | TEMP: 25 ° C. | (1) ACD |
| Meáchan móilíneach | 631.80 |
.
A bhaineann le struchtúr
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Achar dromchla polar | 106 A2 | (1) ACD | |
.
Teirmeach
| Maoin | Luach | Coinníollacha a chur le | Aimsigh |
| Fiuchphointe | 779.4 ± 60.0 ° C. | Brúigh: 760 Torr | (1) ACD |
| Eantalpacht an ghalraithe | 118.97 ± 3.0 kJ/mol | Brúigh: 760 Torr | (1) ACD |
| Bonnphointe | 425.2 ± 32.9 ° C. | (1) ACD |
.
Speictrim ar fáil
1H NMR
13c NMR
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