C21H23N3O5 L-Ornithine, N5-(aminocarbonyl)-N2-[(9H-fluoren-9-ylmethoxy) carbonyl]- (9CI, ACI)

sehlahisoa

C21H23N3O5 L-Ornithine, N5-(aminocarbonyl)-N2-[(9H-fluoren-9-ylmethoxy) carbonyl]- (9CI, ACI)

Lintlha tsa Motheo:


Lintlha tsa Sehlahisoa

Li-tag tsa Sehlahisoa

Lintho tsa 'mele

Lintho Tsa Bohlokoa Tsa 'Mele Boleng Boemo
Boima ba Molek'hule 397.43 -
Sebaka se belang (Se boletsoeng esale pele) 671.5±55.0 °C Tobetsa: 760 Torr
Boima (bo boletsoeng esale pele) 1.316±0.06 g/cm3 Mocheso: 20 °C; Tobetsa: 760 Torr
pKa (E boletsoeng esale pele) 3.84±0,21 Mocheso o nang le Asiti ka ho Fetisisa: 25 °C

Mabitso a Mang le Litlhahiso

Lipososo tsa Canonical O=C(OCC1C=2C=CC=CC2C=3C=CC=CC31)NC(C(=O)O)CCCNC(=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

Senotlolo sa InChi

NBMSMZSRTIOFOK-SFHVURJKSA-N

6 Mabitso a Mang a Ntho ena

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 LEQEPHE: 29 e tsekoang protheine; 909: PN: WO2006135786 LEQEPHE: 59 protheine e batloang; Fmoc-L-Citrulline

Spectra ea Teko

Spectra e fumaneha
1H NMR
13C NMR
Mmisa

Thepa e boletsoeng esale pele

Thepa e teng
Likokoana-hloko
Lik'hemik'hale
Botenya
Lipinski
Sebopeho se Amanang
Mocheso

Likokoana-hloko

Thepa Boleng Boemo Mohloli
Bioconcentration Factor 54.3 pH 1; Mocheso: 25 °C (1) ACD
Bioconcentration Factor 52.8 pH 2; Mocheso: 25 °C (1) ACD
Bioconcentration Factor 40.0 pH 3; Mocheso: 25 °C (1) ACD
Bioconcentration Factor 11.7 pH 4; Mocheso: 25 °C (1) ACD
Bioconcentration Factor 1.45 pH 5; Mocheso: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 6; Mocheso: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 7; Mocheso: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 8; Mocheso: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 9; Mocheso: 25 °C (1) ACD
Bioconcentration Factor 1.0 pH 10; Mocheso: 25 °C (1) ACD

(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lik'hemik'hale

Thepa Boleng Boemo Mohloli
Koc 606 pH 1; Mocheso: 25 °C (1) ACD
Koc 589 pH 2; Mocheso: 25 °C (1) ACD
Koc 446 pH 3; Mocheso: 25 °C (1) ACD
Koc 130 pH 4; Mocheso: 25 °C (1) ACD
Koc 16.2 pH 5; Mocheso: 25 °C (1) ACD

 

Thepa Boleng Boemo Mohloli
Koc 1.76 pH 6; Mocheso: 25 °C (1) ACD
Koc 1.0 pH 7; Mocheso: 25 °C (1) ACD
Koc 1.0 pH 8; Mocheso: 25 °C (1) ACD
Koc 1.0 pH 9; Mocheso: 25 °C (1) ACD
Koc 1.0 pH 10; Mocheso: 25 °C (1) ACD
logD 2.59 pH 1; Mocheso: 25 °C (1) ACD
logD 2.57 pH 2; Mocheso: 25 °C (1) ACD
logD 2.45 pH 3; Mocheso: 25 °C (1) ACD
logD 1.92 pH 4; Mocheso: 25 °C (1) ACD
logD 1.01 pH 5; Mocheso: 25 °C (1) ACD
logD 0.05 pH 6; Mocheso: 25 °C (1) ACD
logD -0.76 pH 7; Mocheso: 25 °C (1) ACD
logD -1.10 pH 8; Mocheso: 25 °C (1) ACD
logD -1.15 pH 9; Mocheso: 25 °C (1) ACD
logD -1.16 pH 10; Mocheso: 25 °C (1) ACD
logP 2.591±0.426 Mocheso: 25 °C (1) ACD
Mass Intrinsic Sollubility 4.8 x 10-3 g/L Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 4.8 x 10-3 g/L pH 1; Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 5.2 x 10-3 g/L pH 2; Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 6.8 x 10-3 g/L pH 3; Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 0.023 g/L pH 4; Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 0.18 g/L pH 5; Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 1.7 g/L pH 6; Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 11 g/L pH 7; Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 23 g/L pH 8; Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 27 g/L pH 9; Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 27 g/L pH 10; Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 0.032 g/L Metsi a sa tsitsang pH 4.18; Mocheso: 25 °C (1) ACD
Molar Intrinsic Solubility 1.2 x 10-5 mol/L Mocheso: 25 °C (1) ACD
Molar Solubility 1.2 x 10-5 mol/L pH 1; Mocheso: 25 °C (1) ACD
Molar Solubility 1.3 x 10-5 mol/L pH 2; Mocheso: 25 °C (1) ACD
Molar Solubility 1.7 x 10-5 mol/L pH 3; Mocheso: 25 °C (1) ACD

 

Thepa Boleng Boemo Mohloli
Molar Solubility 5.7 x 10-5 mol/L pH 4; Mocheso: 25 °C (1) ACD
Molar Solubility 4.6 x 10-4 mol/L pH 5; Mocheso: 25 °C (1) ACD
Molar Solubility 4.2 x 10-3 mol/L pH 6; Mocheso: 25 °C (1) ACD
Molar Solubility 0.027 mol/L pH 7; Mocheso: 25 °C (1) ACD
Molar Solubility 0.059 mol/L pH 8; Mocheso: 25 °C (1) ACD
Molar Solubility 0.067 mol/L pH 9; Mocheso: 25 °C (1) ACD
Molar Solubility 0.068 mol/L pH 10; Mocheso: 25 °C (1) ACD
Molar Solubility 8.0 x 10-5 mol/L Metsi a sa tsitsang pH 4.18; Mocheso: 25 °C (1) ACD
Boima ba Molek'hule 397.43    
pKa 3.84±0,21 Mocheso o nang le Asiti ka ho Fetisisa: 25 °C (1) ACD
pKa -0.21±0,70 Mocheso ka ho Fetisisa oa Motheo: 25 °C (1) ACD
Khatello ea Mouoane 6.01 x 10-19 Torr Mocheso: 25 °C (1) ACD

(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Botenya

Thepa Boleng Boemo Mohloli
Botenya 1.316±0.06 g/cm3 Mocheso: 20 °C; Tobetsa: 760 Torr (1) ACD
Molumo oa Molar 301.8±3.0 cm3/mol Mocheso: 20 °C; Tobetsa: 760 Torr (1) ACD

(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Thepa Boleng Boemo Mohloli
Li-Bonds tse ka fetolehang ka bolokolohi 9   (1) ACD
H Ba amohelang 8   (1) ACD
H Bafani 5   (1) ACD
H Kakaretso ea Mofani/Moamoheli 13   (1) ACD
logP 2.591±0.426 Mocheso: 25 °C (1) ACD
Boima ba Molek'hule 397.43    

(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Sebopeho se Amanang

Thepa Boleng

Boemo

Mohloli
Sebaka sa Polar Surface 131 A2 (1) ACD

(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Mocheso

Thepa Boleng Boemo Mohloli
Ntlha e belang 671.5±55.0 °C Tobetsa: 760 Torr (1) ACD
Enthalpy ea vaporization 103.64±3.0 kJ/mol Tobetsa: 760 Torr (1) ACD
Flash point 359.9±31.5 °C   (1) ACD

(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Spectra e boletsoeng esale pele

Spectra e fumaneha
1H NMR
13C NMR

Boitsebiso ba Taolo

Lethathamo la Taolo: IECSC, TCSI, VNECI Boitsebiso ba Lekunutu ba Khoebo: Sechaba

Regulatory Synonyms
Fmoc-L-2-amino-5-ureido-n-valeric acid IECSC

-

L-Ornithine, N5-(aminocarbonyl)-N2-[(9H-fluoren-9-ylmethoxy)carbonyl]- TCSI, VNECI

-

Lintlha ka Naha/Machabeng & Manane a Mang a Naha/Sebaka Litaba Tse Fumanehang

China Kakaretso

Boemo ba Inventory ho IECSC

Lenane la Lintho Tse Leng Teng tsa Lik'hemik'hale Chaena Mabitso a thathamisitsoeng: Fmoc-L-2-amino-5-ureido-n-valeric acid

Kakaretso ea Taiwan

Boemo ba Lethathamo ho TCSI Taiwan Government Gazette

Kakaretso ea Vietnam

Boemo ba Inventory ho VNECI

Vietnam Draft National Chemical Inventory


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