C21H23N3O5 L-ornitin, N5- (Aminocarbonyl) -N2-[(9H-Fluoren-9-ilmethoxy) carbonyl]-(9CI, ACI)

produi

C21H23N3O5 L-ornitin, N5- (Aminocarbonyl) -N2-[(9H-Fluoren-9-ilmethoxy) carbonyl]-(9CI, ACI)

Enfòmasyon debaz:


Detay Product

Tags pwodwi

Pwopriyete fizik

Kle pwopriyete fizik Valè Kondisyon
Pwa molekilè 397.43 -
Pwen bouyi (prevwa) 671.5 ± 55.0 ° C Peze: 760 Torr
Dansite (prevwa) 1.316 ± 0.06 g/cm3 Tanperati: 20 ° C; Peze: 760 Torr
PKA (prevwa) 3.84 ± 0.21 Pifò asid tanperati: 25 ° C

Lòt non ak idantifyan

Souri kanonyal 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

Inchi kle

Nbmsmzsrtiofok-sfhvurjksa-n

6 Lòt non pou sibstans sa a

N5- (Aminocarbonyl)-N2-[(9H-fluoren-9-ilmethoxy) carbonyl] -l-ornithine (ACI); (2s) -5- (carbamoylamino) -2- (9H-Fluoren-9-ilmethox ycarbonylamino) asid pentanoic; (2s) -5- (carbamoylamino) -2-([((9H-fluoren-9-il) metoksi] carbonyl] amino) pentanoic asid; 218: PN: U S20070042401 Paj: 29 Pwoteyin reklame; 909: PN: WO2006135786 Paj: 59 Pwoteyin reklame; FMOC-L-Citrulline

Espèk eksperimantal

Spèktr ki disponib
1H NMR
13c NMR
Mas

Prevwa pwopriyete

Pwopriyete ki disponib
Biolojik
Chimik
Densite
Lipinski
Estrikti ki gen rapò
Tèmik

Biolojik

Posesyon Valè Kondisyon Sous
Faktè bioconcentration 54.3 Ph 1; Tan: 25 ° C (1) ACD
Faktè bioconcentration 52.8 pH 2; Tan: 25 ° C (1) ACD
Faktè bioconcentration 40.0 pH 3; Tan: 25 ° C (1) ACD
Faktè bioconcentration 11.7 pH 4; Tan: 25 ° C (1) ACD
Faktè bioconcentration 1.45 pH 5; Tan: 25 ° C (1) ACD
Faktè bioconcentration 1.0 pH 6; Tan: 25 ° C (1) ACD
Faktè bioconcentration 1.0 pH 7; Tan: 25 ° C (1) ACD
Faktè bioconcentration 1.0 pH 8; Tan: 25 ° C (1) ACD
Faktè bioconcentration 1.0 pH 9; Tan: 25 ° C (1) ACD
Faktè bioconcentration 1.0 pH 10; Tan: 25 ° C (1) ACD

(1) Kalkile lè l sèvi avèk avanse Chimi Devlopman (ACD/Labs) lojisyèl v11.02 (© 1994-2023 ACD/Labs)

Chimik

Posesyon Valè Kondisyon Sous
Ka 606 Ph 1; Tan: 25 ° C (1) ACD
Ka 589 pH 2; Tan: 25 ° C (1) ACD
Ka 446 pH 3; Tan: 25 ° C (1) ACD
Ka 130 pH 4; Tan: 25 ° C (1) ACD
Ka 16.2 pH 5; Tan: 25 ° C (1) ACD

 

Posesyon Valè Kondisyon Sous
Ka 1.76 pH 6; Tan: 25 ° C (1) ACD
Ka 1.0 pH 7; Tan: 25 ° C (1) ACD
Ka 1.0 pH 8; Tan: 25 ° C (1) ACD
Ka 1.0 pH 9; Tan: 25 ° C (1) ACD
Ka 1.0 pH 10; Tan: 25 ° C (1) ACD
Logd 2.59 Ph 1; Tan: 25 ° C (1) ACD
Logd 2.57 pH 2; Tan: 25 ° C (1) ACD
Logd 2.45 pH 3; Tan: 25 ° C (1) ACD
Logd 1.92 pH 4; Tan: 25 ° C (1) ACD
Logd 1.01 pH 5; Tan: 25 ° C (1) ACD
Logd 0.05 pH 6; Tan: 25 ° C (1) ACD
Logd -0.76 pH 7; Tan: 25 ° C (1) ACD
Logd -1.10 pH 8; Tan: 25 ° C (1) ACD
Logd -1.15 pH 9; Tan: 25 ° C (1) ACD
Logd -1.16 pH 10; Tan: 25 ° C (1) ACD
logp 2.591 ± 0.426 Tan: 25 ° C (1) ACD
Mas solubilite intrinsèques 4.8 x 10-3 g/l Tan: 25 ° C (1) ACD
Mas solubility 4.8 x 10-3 g/l Ph 1; Tan: 25 ° C (1) ACD
Mas solubility 5.2 x 10-3 g/l pH 2; Tan: 25 ° C (1) ACD
Mas solubility 6.8 x 10-3 g/l pH 3; Tan: 25 ° C (1) ACD
Mas solubility 0.023 g/l pH 4; Tan: 25 ° C (1) ACD
Mas solubility 0.18 g/l pH 5; Tan: 25 ° C (1) ACD
Mas solubility 1.7 g/l pH 6; Tan: 25 ° C (1) ACD
Mas solubility 11 g/l pH 7; Tan: 25 ° C (1) ACD
Mas solubility 23 g/l pH 8; Tan: 25 ° C (1) ACD
Mas solubility 27 g/l pH 9; Tan: 25 ° C (1) ACD
Mas solubility 27 g/l pH 10; Tan: 25 ° C (1) ACD
Mas solubility 0.032 g/l PH dlo unbuffered 4.18; Tan: 25 ° C (1) ACD
Molar intrinsèques solubility 1.2 x 10-5 mol/l Tan: 25 ° C (1) ACD
Solubilite molè 1.2 x 10-5 mol/l Ph 1; Tan: 25 ° C (1) ACD
Solubilite molè 1.3 x 10-5 mol/l pH 2; Tan: 25 ° C (1) ACD
Solubilite molè 1.7 x 10-5 mol/l pH 3; Tan: 25 ° C (1) ACD

 

Posesyon Valè Kondisyon Sous
Solubilite molè 5.7 x 10-5 mol/l pH 4; Tan: 25 ° C (1) ACD
Solubilite molè 4.6 x 10-4 mol/l pH 5; Tan: 25 ° C (1) ACD
Solubilite molè 4.2 x 10-3 mol/l pH 6; Tan: 25 ° C (1) ACD
Solubilite molè 0.027 mol/L pH 7; Tan: 25 ° C (1) ACD
Solubilite molè 0.059 mol/L pH 8; Tan: 25 ° C (1) ACD
Solubilite molè 0.067 mol/L pH 9; Tan: 25 ° C (1) ACD
Solubilite molè 0.068 mol/L pH 10; Tan: 25 ° C (1) ACD
Solubilite molè 8.0 x 10-5 mol/l PH dlo unbuffered 4.18; Tan: 25 ° C (1) ACD
Pwa molekilè 397.43    
pka 3.84 ± 0.21 Pifò asid tanperati: 25 ° C (1) ACD
pka -0.21 ± 0.70 Pifò debaz tanperati: 25 ° C (1) ACD
Presyon vapè 6.01 x 10-19 Torr Tan: 25 ° C (1) ACD

(1) Kalkile lè l sèvi avèk avanse Chimi Devlopman (ACD/Labs) lojisyèl v11.02 (© 1994-2023 ACD/Labs)

Densite

Posesyon Valè Kondisyon Sous
Densite 1.316 ± 0.06 g/cm3 Tanperati: 20 ° C; Peze: 760 Torr (1) ACD
Volim molè 301.8 ± 3.0 cm3/mol Tanperati: 20 ° C; Peze: 760 Torr (1) ACD

(1) Kalkile lè l sèvi avèk avanse Chimi Devlopman (ACD/Labs) lojisyèl v11.02 (© 1994-2023 ACD/Labs)

Lipinski

Posesyon Valè Kondisyon Sous
Lib lib wotasyon 9   (1) ACD
H akseptab 8   (1) ACD
H donatè 5   (1) ACD
H donatè/aksepte sòm 13   (1) ACD
logp 2.591 ± 0.426 Tan: 25 ° C (1) ACD
Pwa molekilè 397.43    

(1) Kalkile lè l sèvi avèk avanse Chimi Devlopman (ACD/Labs) lojisyèl v11.02 (© 1994-2023 ACD/Labs)

Estrikti ki gen rapò

Posesyon Valè

Kondisyon

Sous
Zòn sifas polè 131 A2 (1) ACD

(1) Kalkile lè l sèvi avèk avanse Chimi Devlopman (ACD/Labs) lojisyèl v11.02 (© 1994-2023 ACD/Labs)

Tèmik

Posesyon Valè Kondisyon Sous
Pwen bouyi 671.5 ± 55.0 ° C Peze: 760 Torr (1) ACD
Enthalpy nan vaporizasyon 103.64 ± 3.0 kJ/mol Peze: 760 Torr (1) ACD
Pwen flash 359.9 ± 31.5 ° C   (1) ACD

(1) Kalkile lè l sèvi avèk avanse Chimi Devlopman (ACD/Labs) lojisyèl v11.02 (© 1994-2023 ACD/Labs)

Prevwa spèktr

Spèktr ki disponib
1H NMR
13c NMR

Enfòmasyon regilasyon

Lis regilasyon: IECSC, TCSI, VNECI Enfòmasyon sou Biznis Konfidansyèl: Piblik

Sinonim regilasyon
FMOC-L-2-Amino-5-Ureido-N-Valeric Asid IECSC

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L-ornitin, N5- (Aminocarbonyl) -N2-[(9h-fluoren-9-ilmethoxy) carbonyl]- TCSI, VNECI

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Detay pa Peyi/Entènasyonal & Lòt Lis Peyi/Rejyon Enfòmasyon ki disponib

Rezime Lachin

Estati envantè sou IECSC

Envantè nan sibstans chimik ki egziste deja nan Lachin ki nan lis non (yo): FMOC-L-2-Amino-5-Ureido-N-Valeric asid

Rezime Taiwan

Envantè estati sou TCSI Taiwan Gouvènman Gazette

Vyetnam Rezime

Estati envantè sou vneci

Vyetnam Draft Envantè Chimik Nasyonal la


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