C41H39NO6 1-Pyrrolidinacarboicslic Asam, 2 - [BIS (4-Mantexyphenyl) -4-Hydroxy - (2-Ylmethyl Ester, (9 Ci, ACI, ACI, ACI, ACI, ACI, ACI, ACI, ACI)
| Properties fisik Key | Regane | Kondisi |
| Bobot molekuler | 641.75 | - |
| Titik Giling (diprediksi) | 768.7 ± 60,0 ° C | Pencet: 760 torr |
| Kapadhetan (diprediksi) | 1.237 ± 0,06 g / cm3 | Temp: 20 ° C; Pencet: 760 torr |
| Pka (diprediksi) | 14.50 ± 0,40 | Temp paling asam: 25 ° C |
Mesem kanonik o = c (occ1c = 2c = cc = cc = cc = c4 = c6 = c6 = c6 = c6 = c7) c7
Mesem isomerik c (OC @ h] 1n (c (c5 = c5) = c5 = c5) (oc) c7 = c6 = c7 = c7 = c7 = c5
INCI
Kopi = 1s / c41h39no6 / c1-45-3-20-16-29 (17-10-4-3-1-28,30-18-18-18-18-18-18-18-28-122-34 (46-2) 4,3-26-31-2-4 (313) 25-42 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 (31) 40 44) 47-27-37-37-12-3-6-12-35 (37) 39-15-38 (36) 39 / H3-23,31-3-23,31-3-23,31-3-2,39,43H2,1-2h3 / t31-, 32 + / m0 / s1
Kunci inci
Qpxskgjqebdwes-Ajqtzkkkssa-N
2 jeneng liya kanggo zat iki
Asam pyrrolidineCarboinBoics 1 - [[BIS (4-meteixyphenyl) -4-hydroxy-, (2-Ylmethyl ester) - (ZCI); 9h-Fluoren-9-Ylmethyl (2-Ylmethyl (2S, 4R) -2 - [[BIS (4-Mantexyphenyp) -4-hydroxy-1-pyrrolidinecarboxyatate (ACI)
| Properties kasedhiya |
| Biologis |
| Kimia |
| Kapadhetan |
| Lipinski |
| Struktur sing gegandhengan |
| Termal |
Biologis
| Properti | Regane | Kondisi | Sumber |
| Faktor biokentrasi | 1.00 x 106 | PH 1; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | PH 2; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | PH 3; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | pH 4; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | pH 5; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | pH 6; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | PH 7; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | PH 8; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | PH 9; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 1.00 x 106 | PH 10; Temp: 25 ° C | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Kimia
| Properti | Regane | Kondisi | Sumber |
| Koc | 777 x 105 | PH 1; Temp: 25 ° C | (1) ACD |
| Koc | 777 x 105 | PH 2; Temp: 25 ° C | (1) ACD |
| Koc | 777 x 105 | PH 3; Temp: 25 ° C | (1) ACD |
| Koc | 777 x 105 | pH 4; Temp: 25 ° C | (1) ACD |
| Koc | 777 x 105 | pH 5; Temp: 25 ° C | (1) ACD |
| Koc | 777 x 105 | pH 6; Temp: 25 ° C | (1) ACD |
| Koc | 777 x 105 | PH 7; Temp: 25 ° C | (1) ACD |
| Koc | 777 x 105 | PH 8; Temp: 25 ° C | (1) ACD |
| Koc | 777 x 105 | PH 9; Temp: 25 ° C | (1) ACD |
| Koc | 777 x 105 | PH 10; Temp: 25 ° C | (1) ACD |
| Properti | Regane | Kondisi | Sumber |
| logd | 8.29 | PH 1; Temp: 25 ° C | (1) ACD |
| logd | 8.29 | PH 2; Temp: 25 ° C | (1) ACD |
| logd | 8.29 | PH 3; Temp: 25 ° C | (1) ACD |
| logd | 8.29 | pH 4; Temp: 25 ° C | (1) ACD |
| logd | 8.29 | pH 5; Temp: 25 ° C | (1) ACD |
| logd | 8.29 | pH 6; Temp: 25 ° C | (1) ACD |
| logd | 8.29 | PH 7; Temp: 25 ° C | (1) ACD |
| logd | 8.29 | PH 8; Temp: 25 ° C | (1) ACD |
| logd | 8.29 | PH 9; Temp: 25 ° C | (1) ACD |
| logd | 8.29 | PH 10; Temp: 25 ° C | (1) ACD |
| logp | 8.289 ± 0.729 | Temp: 25 ° C | (1) ACD |
| Kelarutan Kelainan Intrinsik Massa | 4.7 x 10-6 g / l | Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.7 x 10-6 g / l | PH 1; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.7 x 10-6 g / l | PH 2; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.7 x 10-6 g / l | PH 3; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.7 x 10-6 g / l | pH 4; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.7 x 10-6 g / l | pH 5; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.7 x 10-6 g / l | pH 6; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.7 x 10-6 g / l | PH 7; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.7 x 10-6 g / l | PH 8; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.7 x 10-6 g / l | PH 9; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.7 x 10-6 g / l | PH 10; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 4.7 x 10-6 g / l | Banyu banyu sing ora diluncurake 7.00; Temp: 25 ° C | (1) ACD |
| Kelarutan Kelaresan Inttrinsik Molar | 7.3 x 10-9 mol / l | Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 7.3 x 10-9 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 7.3 x 10-9 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 7.3 x 10-9 mol / l | PH 3; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 7.3 x 10-9 mol / l | pH 4; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 7.3 x 10-9 mol / l | pH 5; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 7.3 x 10-9 mol / l | pH 6; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 7.3 x 10-9 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 7.3 x 10-9 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
| Properti | Regane | Kondisi | Sumber |
| Kelarutan molar | 7.3 x 10-9 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 7.3 x 10-9 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 7.3 x 10-9 mol / l | Banyu banyu sing ora diluncurake 7.00; Temp: 25 ° C | (1) ACD |
| Bobot molekuler | 641.75 | ||
| PKA | 14.50 ± 0,40 | Temp paling asam: 25 ° C | (1) ACD |
| PKA | -3.24 ± 0,60 | Umume Temp: 25 ° C | (1) ACD |
| Meksa uap | 7.42 x 10-25 Torr | Temp: 25 ° C | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Kapadhetan
| Properti | Regane | Kondisi | Sumber |
| Kapadhetan | 1.237 ± 0,06 g / cm3 | Temp: 20 ° C; Pencet: 760 torr | (1) ACD |
| Jilid Molar | 518.4 ± 3.0 cm3 / mol | Temp: 20 ° C; Pencet: 760 torr | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Lipinski
| Properti | Regane | Kondisi | Sumber |
| Obligasi kanthi bebas | 12 | (1) ACD | |
| H Nampa | 7 | (1) ACD | |
| H donor | 1 | (1) ACD | |
| H Donor / Sumrah Panampa | 8 | (1) ACD | |
| logp | 8.289 ± 0.729 | Temp: 25 ° C | (1) ACD |
| Bobot molekuler | 641.75 |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Struktur sing gegandhengan
| Properti | Regane | Kondisi | Sumber |
| Area permukaan polar | 77.5 A2 | (1) ACD | |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Termal
| Properti | Regane | Kondisi | Sumber |
| Titik Giling | 768.7 ± 60,0 ° C | Pencet: 760 torr | (1) ACD |
| Enthalpy saka Vaporization | 117.42 ± 3.0 kJ / mol | Pencet: 760 torr | (1) ACD |
| Sligan Point | 418.7 ± 32.9 ° C | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Spektrum kasedhiya
1h nmr
13c nmr
![C38h49no7 1- pyrrolroidinedodecanodacyanoic asam, 2- [[bis (4-metexypenly) ethylm] -4-hydroxy-λ-oxo-, (2s) - (ACI)](https://cdn.globalso.com/nvchem/C38H49NO7-1-Pyrrolidinedodecanoic-acid-300x300.jpg)
![C40H49N4O9P Uridinia, 5 '-o- [BIS (4-Mantexyphyl] -2'-Cyanoethyl N, N-BIS (1-Methylethyl) (ACI)](https://cdn.globalso.com/nvchem/C40H49N4O9P-Uridine-300x300.png)
![C10h12n2O5 6h-furo [2 ', 3': 4,5] oxazolo [3,2-a] pyrimidin-6-siji, 9r, 9-metil-, (2r, 9, 9R, 9RA, ACI, ACI, ACI, ACI, ACI, ACI, ACI)](https://cdn.globalso.com/nvchem/C10H12N2O5-6H-Furo-300x300.jpg)
![C30H30N2O8 Uridine, 5'-o- [BIS (4-meteixyphenyl) Phenylmethyl] - (9CI, ACI)](https://cdn.globalso.com/nvchem/C30H30N2O8-Uridine-300x300.jpg)
