![C33H39N5O6 L-FORNITHINAMIDE, N-[(9H-flúoren-9-ylmetoxy) karbónýl] -l-valýl-n5- (amínókarbónýl) -n- [4- (hýdroxýmetýl) fenýl]-(9CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C33H39N5O6 L-Fornithinamide, N-[(9H-flúoren-9-ylmetoxy) karbónýl] -l-valýl-n5- (amínókarbónýl) -n- [4- (hýdroxýmetýl) fenýl]-(9ci, ACI) sem myndin er með mynd](https://cdn.globalso.com/nvchem/C33H39N5O6-L-Ornithinamide.jpg)
C33H39N5O6 L-FORNITHINAMIDE, N-[(9H-flúoren-9-ylmetoxy) karbónýl] -l-valýl-n5- (amínókarbónýl) -n- [4- (hýdroxýmetýl) fenýl]-(9CI, ACI)
| Lykilatriði eðlisfræðilegra eiginleika | Gildi | Ástand |
| Mólmassa | 601.69 | - |
| Suðumark (spáð) | 914,2 ± 65,0 ° C. | Press: 760 Torr |
| Þéttleiki (spáð) | 1,276 ± 0,06 g/cm3 | Temp: 20 ° C; Press: 760 Torr |
| PKA (spáð) | 10,63 ± 0,46 | Sýrtasta temp: 25 ° C |
Canonical bros O = C (Occ1c = 2C = CC = CC2C = 3C = CC = CC31) NC (C (= O) NC (C (= O) NC4 = CC = C (C = C4) CO) CCCNC (= O) N) C (C) C.
Isomeric bros C (OC (N [C@H] (C (N [C@H] (C (NC1 = CC = C (CO) C = C1) = O) CCCNC (N) = O) = O) [C@H] (C) C) = O) C2C = 3C (C = 4C2 = CC = CC4) = CC = CC3
Tommur
Inchi = 1s/C33H39N5O6/C1-20 (2) 29 (38-33 (43) 44-19-27-25-10-5-3-8-23 (25) 24-9-4-6-11-26 (24) 27) 31 (41) 37-28 (12-7-17-35- 32 (34) 42) 30 (40) 36-22-15-13-21 (18-39) 14-16-22/H3-6,8-11,13-16,20,27-29,39H, 7,12,17-19H2,1-2H3, (H, 36,40) (H, 37,41) (H, 38,43) (H34,3
5,42)/T28-, 29-/m0/S1
Inchi lykill
DALMAZHDNFCDRP-VMPREFPWSA-N
1 annað nafn fyrir þetta efni
N-[(9H-flúoren-9-ylmetoxy) karbónýl] -l-valýl-n5- (amínókarbónýl) -n- [4- (hýdroxýmetýl) fenýl] -l-fornamíð (ACI)
Litróf í boði
1H NMR
13c nmr
| Eignir í boði |
| Líffræðileg |
| Efni |
| Þéttleiki |
| Lipinski |
| Uppbygging tengd |
| Hitauppstreymi |
Líffræðileg
| Eign | Gildi | Ástand | Uppspretta |
| Bioconcentration Factor | 809 | pH 1; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 912 | pH 2; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 923 | Ph 3; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 924 | pH 4; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 924 | pH 5; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 924 | pH 6; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 924 | pH 7; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 922 | pH 8; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 903 | pH 9; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 750 | pH 10; Temp: 25 ° C. | (1) ACD |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Efni
| Eign | Gildi | Ástand | Uppspretta |
| KOC | 4040 | pH 1; Temp: 25 ° C. | (1) ACD |
| KOC | 4550 | pH 2; Temp: 25 ° C. | (1) ACD |
| KOC | 4610 | Ph 3; Temp: 25 ° C. | (1) ACD |
| KOC | 4620 | pH 4; Temp: 25 ° C. | (1) ACD |
| KOC | 4620 | pH 5; Temp: 25 ° C. | (1) ACD |
| KOC | 4620 | pH 6; Temp: 25 ° C. | (1) ACD |
| Eign | Gildi | Ástand | Uppspretta |
| KOC | 4620 | pH 7; Temp: 25 ° C. | (1) ACD |
| KOC | 4610 | pH 8; Temp: 25 ° C. | (1) ACD |
| KOC | 4510 | pH 9; Temp: 25 ° C. | (1) ACD |
| KOC | 3740 | pH 10; Temp: 25 ° C. | (1) ACD |
| logd | 4.15 | pH 1; Temp: 25 ° C. | (1) ACD |
| logd | 4.20 | pH 2; Temp: 25 ° C. | (1) ACD |
| logd | 4.20 | Ph 3; Temp: 25 ° C. | (1) ACD |
| logd | 4.20 | pH 4; Temp: 25 ° C. | (1) ACD |
| logd | 4.21 | pH 5; Temp: 25 ° C. | (1) ACD |
| logd | 4.21 | pH 6; Temp: 25 ° C. | (1) ACD |
| logd | 4.20 | pH 7; Temp: 25 ° C. | (1) ACD |
| logd | 4.20 | pH 8; Temp: 25 ° C. | (1) ACD |
| logd | 4.19 | pH 9; Temp: 25 ° C. | (1) ACD |
| logd | 4.11 | pH 10; Temp: 25 ° C. | (1) ACD |
| logp | 4,206 ± 0,767 | Temp: 25 ° C. | (1) ACD |
| Massa eðlislægni | 1,7 x 10-4 g/l | Temp: 25 ° C. | (1) ACD |
| Massa leysni | 2,0 x 10-4 g/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,7 x 10-4 g/l | pH 2; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,7 x 10-4 g/l | Ph 3; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,7 x 10-4 g/l | pH 4; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,7 x 10-4 g/l | pH 5; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,7 x 10-4 g/l | pH 6; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,7 x 10-4 g/l | pH 7; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,7 x 10-4 g/l | pH 8; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,7 x 10-4 g/l | pH 9; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 2,1 x 10-4 g/l | pH 10; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,7 x 10-4 g/l | Óbifað vatn pH 7,00; Temp: 25 ° C. | (1) ACD |
| Molar innri leysni | 2,9 x 10-7 mól/l | Temp: 25 ° C. | (1) ACD |
| Molar leysni | 3,3 x 10-7 mól/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 2,9 x 10-7 mól/l | pH 2; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 2,9 x 10-7 mól/l | Ph 3; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 2,9 x 10-7 mól/l | pH 4; Temp: 25 ° C. | (1) ACD |
| Eign | Gildi | Ástand | Uppspretta |
| Molar leysni | 2,9 x 10-7 mól/l | pH 5; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 2,9 x 10-7 mól/l | pH 6; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 2,9 x 10-7 mól/l | pH 7; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 2,9 x 10-7 mól/l | pH 8; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 2,9 x 10-7 mól/l | pH 9; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 3,5 x 10-7 mól/l | pH 10; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 2,9 x 10-7 mól/l | Óbifað vatn pH 7,00; Temp: 25 ° C. | (1) ACD |
| Mólmassa | 601.69 | ||
| PKA | 10,63 ± 0,46 | Sýrtasta temp: 25 ° C | (1) ACD |
| PKA | 0,13 ± 0,50 | Grundvöllurinn: 25 ° C | (1) ACD |
| Gufuþrýstingur | 0 Torr | Temp: 25 ° C. | (1) ACD |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Þéttleiki
| Eign | Gildi | Ástand | Uppspretta |
| Þéttleiki | 1,276 ± 0,06 g/cm3 | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
| Mólmagn | 471,2 ± 3,0 cm3/mól | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Eign | Gildi | Ástand | Uppspretta |
| Frjálslega snúningsbönd | 15 | (1) ACD | |
| H samþykki | 11 | (1) ACD | |
| H styrktaraðilar | 7 | (1) ACD | |
| H gjafa/samþykki fjárhæð | 18 | (1) ACD | |
| logp | 4,206 ± 0,767 | Temp: 25 ° C. | (1) ACD |
| Mólmassa | 601.69 |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Uppbygging tengd
| Eign | Gildi | Ástand | Uppspretta |
| Polar yfirborð | 172 A2 | (1) ACD | |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Hitauppstreymi
| Eign | Gildi | Ástand | Uppspretta |
| Suðumark | 914,2 ± 65,0 ° C. | Press: 760 Torr | (1) ACD |
| Enthalpy af gufu | 139,25 ± 3,0 kJ/mól | Press: 760 Torr | (1) ACD |
| Flashpunktur | 506,7 ± 34,3 ° C. | (1) ACD |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Litróf í boði
1H NMR
13c nmr
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