![C21H23N3O5 L-Ornithine, N5- (aminocarbonyl) -N2- [(9H-fluoren-9-ylmethoxy) carbonyl]- (9CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C21H23N3O5 L-Ornithine, N5- (aminocarbonyl) -N2-[(9H-fluoren-9-ylmethoxy) carbonyl]- (9CI, ACI) Foto egosipụtara](https://cdn.globalso.com/nvchem/C21H23N3O5-L-Ornithine.jpg)
C21H23N3O5 L-Ornithine, N5- (aminocarbonyl) -N2- [(9H-fluoren-9-ylmethoxy) carbonyl]- (9CI, ACI)
| Njirimara anụ ahụ igodo | Uru | Ọnọdụ |
| Ibu molekụla | 397.43 | - |
| Ebe a na-esi esi esi (buru amụma) | 671.5±55.0 Celsius | Pịa: 760 Torr |
| Njupụta (buru amụma) | 1.316±0.06 g/cm3 | Okpomọkụ: 20 °C;Pịa: 760 Torr |
| pKa (buru amụma) | 3.84± 0.21 | Okpomọkụ kachasị acidic: 25 Celsius |
Canonical SILES O=C(OCC1C=2C=CC=CC2C=3C=CC=CC31)NC(C(=O)O)CCCCNC(=O)N
Isomeric 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) 14-7-2-4-9-16 (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 Igodo
NBMSMZSRTIOFOK-SFHVURJKSA-N
6 Aha ndị ọzọ maka ihe a
N5- (Aminocarbonyl)N2-[(9H-fluoren-9-ylmethoxy)carbonyl] -L-ornithine (ACI);(2S)-5-(Carbamoylamino)-2-(9H-fluoren-9-ylmethox ycarbonylamino) pentanoic acid;(2S)-5-(Carbamoylamino)-2-([[(9H-fluoren-9-yl) methoxy] carbonyl] amino) pentanoic acid;218: PN: U S20070042401 PEEJI: 29 kwuru na protein;909: PN: WO2006135786 PEEJI: 59 kwuru na protein;Fmoc-L-Citrulline
Spectra dị
1H NMR
13C NMR
Mass
| Ngwongwo dị |
| Usoro ndu |
| Chemical |
| Njupụta |
| Lipinski |
| Ọdịdị metụtara |
| Thermal |
Usoro ndu
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Ihe kpatara bioconcentration | 54.3 | pH 1;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 52.8 | pH 2;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 40.0 | pH 3;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 11.7 | pH 4;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.45 | pH 5;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 6;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 7;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 8;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 9;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.0 | pH 10;Okpomọkụ: 25 Celsius C | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Chemical
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Koc | 606 | pH 1;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 589 | pH 2;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 446 | pH 3;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 130 | pH 4;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 16.2 | pH 5;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Koc | 1.76 | pH 6;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 1.0 | pH 7;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 1.0 | pH 8;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 1.0 | pH 9;Okpomọkụ: 25 Celsius C | (1) ACD |
| Koc | 1.0 | pH 10;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 2.59 | pH 1;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 2.57 | pH 2;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 2.45 | pH 3;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 1.92 | pH 4;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 1.01 | pH 5;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 0.05 | pH 6;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -0.76 | pH 7;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -1.10 | pH 8;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -1.15 | pH 9;Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | -1.16 | pH 10;Okpomọkụ: 25 Celsius C | (1) ACD |
| logP | 2.591± 0.426 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ọkachamara Solubility dị n'ime | 4.8 x 10-3 g/L | Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 4.8 x 10-3 g/L | pH 1;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 5.2 x 10-3 g/L | pH 2;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 6.8 x 10-3 g/L | pH 3;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0.023 g/L | pH 4;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0.18 g/L | pH 5;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.7 g/L | pH 6;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 11 g/l | pH 7;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 23 g/L | pH 8;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 27 g/l | pH 9;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 27 g/l | pH 10;Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0.032 g/L | Mmiri na-enweghị atụ pH 4.18;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility dị n'ime Molar | 1.2 x 10-5 mol / l | Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.2 x 10-5 mol / l | pH 1;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.3 x 10-5 mol / l | pH 2;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.7 x 10-5 mol / l | pH 3;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Solubility Molar | 5.7 x 10-5 mol / l | pH 4;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 4.6 x 10-4 mol/L | pH 5;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 4.2 x 10-3 mol / l | pH 6;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 0.027 mol / l | pH 7;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 0.059 mol / l | pH 8;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 0.067 mol / l | pH 9;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 0.068 mol / l | pH 10;Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 8.0 x 10-5 mol / l | Mmiri na-enweghị atụ pH 4.18;Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 397.43 | ||
| pKa | 3.84± 0.21 | Okpomọkụ kachasị acidic: 25 Celsius | (1) ACD |
| pKa | -0.21 ± 0.70 | Okpomọkụ kachasị mma: 25 Celsius | (1) ACD |
| Uzuoku Nrụgide | 6.01 x 10-19 Torr | Okpomọkụ: 25 Celsius C | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Njupụta
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Njupụta | 1.316±0.06 g/cm3 | Okpomọkụ: 20 °C;Pịa: 760 Torr | (1) ACD |
| Olu Molar | 301.8± 3.0 cm3 / mol | Okpomọkụ: 20 °C;Pịa: 760 Torr | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Nkwekọrịta na-agbanwe agbanwe n'efu | 9 | (1) ACD | |
| H Ndị nnabata | 8 | (1) ACD | |
| H Ndị na-enye onyinye | 5 | (1) ACD | |
| H Donor/Anabata Nchikota | 13 | (1) ACD | |
| logP | 2.591± 0.426 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 397.43 |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Ọdịdị metụtara
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Mpaghara elu elu | 131 A2 | (1) ACD | |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Thermal
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Ebe esi nri | 671.5±55.0 Celsius | Pịa: 760 Torr | (1) ACD |
| Enthalpy nke Vaporization | 103.64± 3.0 kJ/mol | Pịa: 760 Torr | (1) ACD |
| Ebe mgbari | 359.9±31.5C | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra dị
1H NMR
13C NMR
Ndepụta usoro iwu: IECSC, TCSI, VNECI Ozi nzuzo nzuzo: Ọha
| Okwu ndakọrịta | ||
| Fmoc-L-2-amino-5-ureido-n-valeric acid | IECSC | - |
| L-Ornithine, N5- (aminocarbonyl) -N2- [(9H-fluoren-9-ylmethoxy) carbon] - | TCSI, VNECI | - |
Nkọwa site na obodo/mba mba na ozi obodo/mpaghara ndepụta ndị ọzọ dị
Nchịkọta China
Ọnọdụ ngwa ahịa na IECSC
Ndepụta nke ihe kemịkalụ dị adị na China Edepụtara aha(s): Fmoc-L-2-amino-5-ureido-n-valeric acid
Nchịkọta Taiwan
Ọnọdụ ngwa ahịa na TCSI Taiwan Government Gazette
Viet Nam nchịkọta
Ọnọdụ ngwa ahịa na VNECI
Vietnam Draft National Chemical Inventory
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