![C21H23N3O5 l-nornithine, N5- (aminocarbonyl) -n2-[(9H-fluoren-9-ylmethoxy) carbonyl]-(9ci, aci)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C21H23N3O5 L-ORDHINE, N5- (Aminocarbonyl) -N2-[(9H-fluoren-9-ylmethoxy) carbonyl]-(9ci, aci)](https://cdn.globalso.com/nvchem/C21H23N3O5-L-Ornithine.jpg)
C21H23N3O5 l-nornithine, N5- (aminocarbonyl) -n2-[(9H-fluoren-9-ylmethoxy) carbonyl]-(9ci, aci)
| Sifat fizikal utama | Nilai | Keadaan |
| Berat molekul | 397.43 | - |
| Titik mendidih (diramalkan) | 671.5 ± 55.0 ° C. | Tekan: 760 Torr |
| Ketumpatan (diramalkan) | 1.316 ± 0.06 g/cm3 | Temp: 20 ° C; Tekan: 760 Torr |
| PKA (diramalkan) | 3.84 ± 0.21 | Tempatan yang paling berasid: 25 ° C |
Senyuman kanonik o = c (occ1c = 2c = cc = cc2c = 3c = cc = cc31) nc (c (= o) o) cccnc (= o) n
Isomerik Smiles C (OC (N [C @@ H] (CCCNC (N) = O) C (O) = O) = O) C1C = 2C (C = 3C1 = CC = CC3) = CC = CC2
Inchi
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) 14-7-2-9-16 (14) 5,10-12H2, (h, 24,28) (h, 25,26) (H3,22,23,27)/T18-/m0/s1
Kunci Inchi
Nbmsmzsrtiofok-sfhvurjksa-n
6 nama lain untuk bahan ini
N5- (aminocarbonyl)-N2-[(9H-fluoren-9-ylmethoxy) carbonyl] -l-ornithine (ACI); (2s) -5- (Carbamoylamino) -2- (9H-fluoren-9-ylmethox ycarbonylamino) asid pentanoic; (2s) -5- (Carbamoylamino) -2-([[(9H-fluoren-9-yl) methoxy] carbonyl] amino) asid pentanoik; 218: PN: U S20070042401 Page: 29 Protein yang dituntut; 909: PN: WO2006135786 Halaman: 59 Protein yang dituntut; FMOC-L-Citrulline
Spektrum tersedia
1H NMR
13C NMR
Massa
| Hartanah tersedia |
| Biologi |
| Kimia |
| Ketumpatan |
| Lipinski |
| Struktur berkaitan |
| Haba |
Biologi
| Harta | Nilai | Keadaan | Sumber |
| Faktor Biokonsentrasi | 54.3 | pH 1; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 52.8 | pH 2; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 40.0 | pH 3; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 11.7 | pH 4; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 1.45 | pH 5; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 1.0 | pH 6; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 1.0 | pH 7; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 1.0 | pH 8; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 1.0 | pH 9; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 1.0 | pH 10; Temp: 25 ° C. | (1) ACD |
(1) Dikira Menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Kimia
| Harta | Nilai | Keadaan | Sumber |
| 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 |
| Harta | Nilai | Keadaan | Sumber |
| 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 |
| Kelarutan intrinsik massa | 4.8 x 10-3 g/l | Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 4.8 x 10-3 g/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 5.2 x 10-3 g/l | pH 2; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 6.8 x 10-3 g/l | pH 3; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 0.023 g/l | pH 4; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 0.18 g/l | pH 5; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 1.7 g/l | pH 6; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 11 g/l | pH 7; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 23 g/l | pH 8; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 27 g/l | pH 9; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 27 g/l | pH 10; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 0.032 g/l | PH Air yang tidak disengajakan 4.18; Temp: 25 ° C. | (1) ACD |
| Kelarutan intrinsik molar | 1.2 x 10-5 mol/l | Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 1.2 x 10-5 mol/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 1.3 x 10-5 mol/l | pH 2; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 1.7 x 10-5 mol/l | pH 3; Temp: 25 ° C. | (1) ACD |
| Harta | Nilai | Keadaan | Sumber |
| Kelarutan molar | 5.7 x 10-5 mol/l | pH 4; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 4.6 x 10-4 mol/l | pH 5; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 4.2 x 10-3 mol/l | pH 6; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 0.027 mol/l | pH 7; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 0.059 mol/l | pH 8; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 0.067 mol/l | pH 9; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 0.068 mol/l | pH 10; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 8.0 x 10-5 mol/l | PH Air yang tidak disengajakan 4.18; Temp: 25 ° C. | (1) ACD |
| Berat molekul | 397.43 | ||
| PKA | 3.84 ± 0.21 | Tempatan yang paling berasid: 25 ° C | (1) ACD |
| PKA | -0.21 ± 0.70 | Tempatan paling asas: 25 ° C | (1) ACD |
| Tekanan wap | 6.01 x 10-19 Torr | Temp: 25 ° C. | (1) ACD |
(1) Dikira Menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Ketumpatan
| Harta | Nilai | Keadaan | Sumber |
| Ketumpatan | 1.316 ± 0.06 g/cm3 | Temp: 20 ° C; Tekan: 760 Torr | (1) ACD |
| Jumlah molar | 301.8 ± 3.0 cm3/mol | Temp: 20 ° C; Tekan: 760 Torr | (1) ACD |
(1) Dikira Menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Harta | Nilai | Keadaan | Sumber |
| Ikatan bebas berputar | 9 | (1) ACD | |
| H penerima | 8 | (1) ACD | |
| H penderma | 5 | (1) ACD | |
| H penderma/penerima jumlah | 13 | (1) ACD | |
| logp | 2.591 ± 0.426 | Temp: 25 ° C. | (1) ACD |
| Berat molekul | 397.43 |
(1) Dikira Menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Struktur berkaitan
| Harta | Nilai | Keadaan | Sumber |
| Kawasan permukaan kutub | 131 A2 | (1) ACD | |
(1) Dikira Menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Haba
| Harta | Nilai | Keadaan | Sumber |
| Titik mendidih | 671.5 ± 55.0 ° C. | Tekan: 760 Torr | (1) ACD |
| Entalpi pengewapan | 103.64 ± 3.0 kJ/mol | Tekan: 760 Torr | (1) ACD |
| Titik kilat | 359.9 ± 31.5 ° C. | (1) ACD |
(1) Dikira Menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Spektrum tersedia
1H NMR
13C NMR
Senarai pengawalseliaan: IECSC, TCSI, VNECI Maklumat Perniagaan Rahsia: Awam
| Sinonim pengawalseliaan | ||
| FMOC-L-2-AMINO-5-INEIDO-N-VALERIC ACID | IECSC | - |
| L-ordithine, n5- (aminocarbonyl) -n2-[(9H-fluoren-9-ylmethoxy) carbonyl]- | Tcsi, vneci | - |
Butiran mengikut maklumat negara/antarabangsa & lain -lain maklumat negara/rantau yang ada
Ringkasan China
Status inventori di IECSC
Inventori bahan kimia yang ada di China Nama yang disenara
Ringkasan Taiwan
Status inventori di Warta Kerajaan TCSI Taiwan
Ringkasan Viet Nam
Status inventori di vneci
Vietnam Draf Inventori Kimia Kebangsaan
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