C21H23N3O5 L-ornithine, N5- (Aminocarbonyl) -N2 - [(9h-Fluoren-9-Ylmethoxy) - (9CI, ACI)

Produk

C21H23N3O5 L-ornithine, N5- (Aminocarbonyl) -N2 - [(9h-Fluoren-9-Ylmethoxy) - (9CI, ACI)

Informasi dhasar:


Detail Produk

Tag Produk

Properties fisik

Properties fisik Key Regane Kondisi
Bobot molekuler 397.43 -
Titik Giling (diprediksi) 671.5 ± 55.0 ° C Pencet: 760 torr
Kapadhetan (diprediksi) 1.316 ± 0,06 g / cm3 Temp: 20 ° C; Pencet: 760 torr
Pka (diprediksi) 3.84 ± 0.21 Temp paling asam: 25 ° C

Jeneng lan Identifikasi Liyane

Mesem kanonik o = c (occ1c = 2c = cc = cc = cc2c = 3c = cc = cc31) nc (c (= o) o) cccnc (= o) n

Mesem isomerik c (oc (n [C @@ h] (n) (o) c (o) = c1c = 2c (c = 3c = cc = cc = cc = cc = cc = cc = cc = CC = CC = CC

INCI

Kopi = 1s / c21h23N3o5 / C22-20 (27) 23-11-5-10-18 (19) 14-3-3-15-9-16 (14) 17/19-18) 5.10-12h2, (h, 24,28) (h, 25,26) (H3,22,23,27) / t18- / m0 / s1

Kunci inci

NBMSMZSRTRTIOFOK-SFHVURJKSA-N

6 Jeneng liya kanggo zat iki

N5- (aminocoronl) -N2 - [(9H-Fluoren-9-ylmethoxy) Carbonyl] -l-ornithine (ACI); (2s) -5- (karbamoylamamino) -2- (9H-fluoren-9-ylmethox ycarbonylamino) asam pentano; (2s) -5- (karbamoylamamino) -2 - ([[(9H-Fluoren-9-yl) MileXY] CarbonyL] Amino) Pentanoic Asam; 218: PN: U s20070042401 Kaca: 29 Protein ngaku; 909: PN: WO2006135786 Halaman: 59 ngaku protein; FMOC-L-Citrulli

Spektral Eksperimen

Spektrum kasedhiya
1h nmr
13c NMR
Massa

Properti sing diramalake

Properties kasedhiya
Biologis
Kimia
Kapadhetan
Lipinski
Struktur sing gegandhengan
Termal

Biologis

Properti Regane Kondisi Sumber
Faktor biokentrasi 54.3 PH 1; Temp: 25 ° C (1) ACD
Faktor biokentrasi 52.8 PH 2; Temp: 25 ° C (1) ACD
Faktor biokentrasi 40.0 PH 3; Temp: 25 ° C (1) ACD
Faktor biokentrasi 11.7 pH 4; Temp: 25 ° C (1) ACD
Faktor biokentrasi 1.45 pH 5; Temp: 25 ° C (1) ACD
Faktor biokentrasi 1.0 pH 6; Temp: 25 ° C (1) ACD
Faktor biokentrasi 1.0 pH 7; Temp: 25 ° C (1) ACD
Faktor biokentrasi 1.0 PH 8; Temp: 25 ° C (1) ACD
Faktor biokentrasi 1.0 PH 9; Temp: 25 ° C (1) ACD
Faktor biokentrasi 1.0 PH 10; Temp: 25 ° C (1) ACD

(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)

Kimia

Properti Regane Kondisi 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

 

Properti Regane Kondisi 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 Kelainan 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 Banyu banyu sing ora diluncurake 4.18; Temp: 25 ° C (1) ACD
Kelarutan Kelaresan Inttrinsik 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

 

Properti Regane Kondisi 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 Banyu banyu sing ora diluncurake 4.18; Temp: 25 ° C (1) ACD
Bobot molekuler 397.43    
PKA 3.84 ± 0.21 Temp paling asam: 25 ° C (1) ACD
PKA -0.21 ± 070 Umume Temp: 25 ° C (1) ACD
Meksa uap 6.01 x 10-19 Torr Temp: 25 ° C (1) ACD

(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)

Kapadhetan

Properti Regane Kondisi Sumber
Kapadhetan 1.316 ± 0,06 g / cm3 Temp: 20 ° C; Pencet: 760 torr (1) ACD
Jilid Molar 301.8 ± 3.0 cm3 / mol Temp: 20 ° C; Pencet: 760 torr (1) ACD

(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)

Lipinski

Properti Regane Kondisi Sumber
Obligasi kanthi bebas 9   (1) ACD
H Nampa 8   (1) ACD
H donor 5   (1) ACD
H Donor / Sumrah Panampa 13   (1) ACD
logp 2.591 ± 0.426 Temp: 25 ° C (1) ACD
Bobot molekuler 397.43    

(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)

Struktur sing gegandhengan

Properti Regane

Kondisi

Sumber
Area permukaan polar 131 A2 (1) ACD

(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)

Termal

Properti Regane Kondisi Sumber
Titik Giling 671.5 ± 55.0 ° C Pencet: 760 torr (1) ACD
Enthalpy saka Vaporization 103.64 ± 3.0 kJ / mol Pencet: 760 torr (1) ACD
Sligan Point 359.9 ± 31,5 ° C   (1) ACD

(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)

Diramalake spektrasi

Spektrum kasedhiya
1h nmr
13c NMR

Informasi reguler

Dhaptar Regulasi: IECSC, TCSI, Informasi Bisnis Konfigurasi Vneci: Umum

Regulasi sinonim
FMOC-L-2-5-Ureido-N-Valoris Asam IECSC

-

L-Ornithine, N5- (AminocarbonyL) -N2 - [(9h-Fluoren-9-Ylmethoxy) Tcsi, vneci

-

Rincian miturut negara / internasional & dhaptar informasi negara / wilayah sing kasedhiya

Ringkesan China

Status Inventori ing IECSC

Inventori bahan kimia sing ana ing jeneng (s) jeneng China: FMOC-L-2-AMINO-5-Ureido-N-Valeric

Ringkesan Taiwan

Status Inventori ing TCSI Taiwan Goverette

Ringkesan Viet Nam

Status Inventori ing Vneci

Persediaan Kimia Vietnam Nasional


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