![C21H23N3O5 L-Angithine, N5- (Aminocarbonyl) -N2-[(9H-FLUOREN-9-ylmethoxy) carbonyl]-(9ci, aci)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C21H23N3O5 L-Angithine, N5- (Aminocarbonyl) -N2-[(9H-FLUOREN-9-ylmethoxy) carbonyl]-(9ci, ACI).](https://cdn.globalso.com/nvchem/C21H23N3O5-L-Ornithine.jpg)
C21H23N3O5 L-Angithine, N5- (Aminocarbonyl) -N2-[(9H-FLUOREN-9-ylmethoxy) carbonyl]-(9ci, aci)
| Belangrike fisiese eienskappe | Waarde | Toestand |
| Molekulêre gewig | 397.43 | - |
| Kookpunt (voorspel) | 671,5 ± 55,0 ° C | Druk: 760 Torr |
| Digtheid (voorspel) | 1,316 ± 0,06 g/cm3 | Temp: 20 ° C; Druk: 760 Torr |
| PKA (voorspel) | 3,84 ± 0,21 | Die meeste suur temp: 25 ° C |
Kanonieke glimlagte o = c (occ1c = 2c = cc = cc2c = 3c = cc = cc31) nc (c (= o) o) cccnc (= o) n
Isomeriese glimlag c (oc (n [c @@ h] (cccnc (n) = o) c (o) = o) = o) c1c = 2c (c = 3c1 = cc = cc3) = cc = cc2
Duim
Inchi = 1s/c21h23n3o5/c22-20 (27) 23-11-5-10-18 (19 (25) 26) 24-21 (28) 29-12-17-15-8-3-1-6-13 (15) 14-7-2-4-9-16 (14) 17/H1-4,6-9,17-18h, 5,10-12H2, (H, 24,28) (H, 25,26) (H3,22,23,27)/T18-/M0/S1
Inchi -sleutel
Nbmsmzsrtiofok-sfhvurjksa-n
6 Ander name vir hierdie stof
N5- (aminokarboniel)-N2-[(9H-fluoren-9-ylmethoxy) karboniel] -l-boor (ACI); (2s) -5- (carbamoylamino) -2- (9H-fluoren-9-ylmethox ycarbonylamino) pentanoïensuur; (2s) -5- (carbamoylamino) -2-([[(9H-fluoren-9-yl) methoxy] karboniel] amino) pentanoïensuur; 218: PN: U S20070042401 Bladsy: 29 Proteïen geëis; 909: PN: WO2006135786 Bladsy: 59 Proteïen geëis; Fmoc-l-citrulline
Spektra beskikbaar
1H NMR
13C NMR
Massa
| Eiendom beskikbaar |
| Biologies |
| Chemies |
| Digtheid |
| Lipinski |
| Struktuurverwant |
| Termies |
Biologies
| Eiendom | Waarde | Toestand | Bron |
| Biokonsentrasiefaktor | 54.3 | Ph 1; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 52.8 | Ph 2; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 40.0 | Ph 3; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 11.7 | Ph 4; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 1.45 | Ph 5; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 1.0 | Ph 6; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 1.0 | Ph 7; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 1.0 | Ph 8; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 1.0 | Ph 9; Temp: 25 ° C | (1) ACD |
| Biokonsentrasiefaktor | 1.0 | Ph 10; Temp: 25 ° C | (1) ACD |
(1) Bereken met behulp van gevorderde chemie-ontwikkeling (ACD/labs) sagteware v11.02 (© 1994-2023 ACD/LABS)
Chemies
| Eiendom | Waarde | Toestand | Bron |
| KOC | 606 | Ph 1; Temp: 25 ° C | (1) ACD |
| KOC | 589 | Ph 2; Temp: 25 ° C | (1) ACD |
| KOC | 446 | Ph 3; Temp: 25 ° C | (1) ACD |
| KOC | 130 | Ph 4; Temp: 25 ° C | (1) ACD |
| KOC | 16.2 | Ph 5; Temp: 25 ° C | (1) ACD |
| Eiendom | Waarde | Toestand | Bron |
| KOC | 1.76 | Ph 6; Temp: 25 ° C | (1) ACD |
| KOC | 1.0 | Ph 7; Temp: 25 ° C | (1) ACD |
| KOC | 1.0 | Ph 8; Temp: 25 ° C | (1) ACD |
| KOC | 1.0 | Ph 9; Temp: 25 ° C | (1) ACD |
| KOC | 1.0 | Ph 10; Temp: 25 ° C | (1) ACD |
| logd | 2.59 | Ph 1; Temp: 25 ° C | (1) ACD |
| logd | 2.57 | Ph 2; Temp: 25 ° C | (1) ACD |
| logd | 2.45 | Ph 3; Temp: 25 ° C | (1) ACD |
| logd | 1.92 | Ph 4; Temp: 25 ° C | (1) ACD |
| logd | 1.01 | Ph 5; Temp: 25 ° C | (1) ACD |
| logd | 0,05 | Ph 6; Temp: 25 ° C | (1) ACD |
| logd | -0.76 | Ph 7; Temp: 25 ° C | (1) ACD |
| logd | -1.10 | Ph 8; Temp: 25 ° C | (1) ACD |
| logd | -1.15 | Ph 9; Temp: 25 ° C | (1) ACD |
| logd | -1.16 | Ph 10; Temp: 25 ° C | (1) ACD |
| logp | 2.591 ± 0.426 | Temp: 25 ° C | (1) ACD |
| Massa intrinsieke oplosbaarheid | 4,8 x 10-3 g/l | Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 4,8 x 10-3 g/l | Ph 1; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 5.2 x 10-3 g/l | Ph 2; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 6,8 x 10-3 g/l | Ph 3; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 0,023 g/l | Ph 4; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 0,18 g/l | Ph 5; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 1,7 g/l | Ph 6; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 11 g/l | Ph 7; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 23 g/l | Ph 8; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 27 g/l | Ph 9; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 27 g/l | Ph 10; Temp: 25 ° C | (1) ACD |
| Massa -oplosbaarheid | 0,032 g/l | Ongebufferde water pH 4.18; Temp: 25 ° C | (1) ACD |
| Molêre intrinsieke oplosbaarheid | 1,2 x 10-5 mol/l | Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 1,2 x 10-5 mol/l | Ph 1; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 1,3 x 10-5 mol/l | Ph 2; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 1,7 x 10-5 mol/l | Ph 3; Temp: 25 ° C | (1) ACD |
| Eiendom | Waarde | Toestand | Bron |
| Molêre oplosbaarheid | 5,7 x 10-5 mol/l | Ph 4; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 4.6 x 10-4 mol/l | Ph 5; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 4.2 x 10-3 mol/l | Ph 6; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 0,027 mol/l | Ph 7; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 0,059 mol/l | Ph 8; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 0,067 mol/l | Ph 9; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 0,068 mol/l | Ph 10; Temp: 25 ° C | (1) ACD |
| Molêre oplosbaarheid | 8,0 x 10-5 mol/l | Ongebufferde water pH 4.18; Temp: 25 ° C | (1) ACD |
| Molekulêre gewig | 397.43 | ||
| pka | 3,84 ± 0,21 | Die meeste suur temp: 25 ° C | (1) ACD |
| pka | -0,21 ± 0,70 | Die meeste basiese temp: 25 ° C | (1) ACD |
| Dampdruk | 6,01 x 10-19 Torr | Temp: 25 ° C | (1) ACD |
(1) Bereken met behulp van gevorderde chemie-ontwikkeling (ACD/labs) sagteware v11.02 (© 1994-2023 ACD/LABS)
Digtheid
| Eiendom | Waarde | Toestand | Bron |
| Digtheid | 1,316 ± 0,06 g/cm3 | Temp: 20 ° C; Druk: 760 Torr | (1) ACD |
| Molêre volume | 301,8 ± 3,0 cm3/mol | Temp: 20 ° C; Druk: 760 Torr | (1) ACD |
(1) Bereken met behulp van gevorderde chemie-ontwikkeling (ACD/labs) sagteware v11.02 (© 1994-2023 ACD/LABS)
Lipinski
| Eiendom | Waarde | Toestand | Bron |
| Vrylik draaibare bindings | 9 | (1) ACD | |
| H Acceptors | 8 | (1) ACD | |
| H -donateurs | 5 | (1) ACD | |
| H Skenker/Acceptor Sum | 13 | (1) ACD | |
| logp | 2.591 ± 0.426 | Temp: 25 ° C | (1) ACD |
| Molekulêre gewig | 397.43 |
(1) Bereken met behulp van gevorderde chemie-ontwikkeling (ACD/labs) sagteware v11.02 (© 1994-2023 ACD/LABS)
Struktuurverwant
| Eiendom | Waarde | Toestand | Bron |
| Pooloppervlakte | 131 A2 | (1) ACD | |
(1) Bereken met behulp van gevorderde chemie-ontwikkeling (ACD/labs) sagteware v11.02 (© 1994-2023 ACD/LABS)
Termies
| Eiendom | Waarde | Toestand | Bron |
| Kookpunt | 671,5 ± 55,0 ° C | Druk: 760 Torr | (1) ACD |
| Entalpie van verdamping | 103,64 ± 3,0 kJ/mol | Druk: 760 Torr | (1) ACD |
| Flitspunt | 359,9 ± 31,5 ° C | (1) ACD |
(1) Bereken met behulp van gevorderde chemie-ontwikkeling (ACD/labs) sagteware v11.02 (© 1994-2023 ACD/LABS)
Spektra beskikbaar
1H NMR
13C NMR
Reguleringslys: IECSC, TCSI, VNECI Vertroulike besigheidsinligting: publiek
| Regulatoriese sinonieme | ||
| FMOC-L-2-Amino-5-Uureido-N-Valeriese suur | IECSC | - |
| L-ornitien, n5- (aminokarboniel) -n2-[(9h-fluoren-9-ylmethoxy) karboniel]- | TCSI, Vneci | - |
Besonderhede per land/internasionale en ander lyste land/streekinligting beskikbaar
China -opsomming
Voorraadstatus op IECSC
Inventaris van bestaande chemiese stowwe in China-genoteerde naam (s): FMOC-L-2-amino-5-Uureido-N-Valeric Acid
Taiwan opsomming
Voorraadstatus op TCSI Taiwan Government Gazette
Viëtnam -opsomming
Voorraadstatus op Vneci
Vietnam konsep nasionale chemiese voorraad
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