![C20h31NO5 I-Heptanoic acid, 3- hydroxy-5-methyl-4 - [[phenylmethoxy) carbonyl] Amino] - [1,1-dimethylethyl ester, [3r- (3r *, 4s *, (9ci) H301](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C20h31NO5 I-Heptanoic acid, 3- hydroxy-5-methyl-4 - [[phenylmethoxy) carbonyl] Amino] - [1,1-dimethylethyl ester, [3r- (3r *, 4S *, (9ci) H301 Isithombe](https://cdn.globalso.com/nvchem/C20H31NO5-Heptanoic-acid.jpg)
C20h31NO5 I-Heptanoic acid, 3- hydroxy-5-methyl-4 - [[phenylmethoxy) carbonyl] Amino] - [1,1-dimethylethyl ester, [3r- (3r *, 4s *, (9ci) H301
| Izakhiwo ezisemqoka ezisemqoka | Thanda | Into efunekayo |
| Isisindo molecular | 365.46 | - |
| Iphoyinti elibilayo (abikezelwe) | 504.1 ± 50.0 ° C | Cindezela: 760 Torr |
| Ubuningi (obubikezelwe) | I-1.091 ± 0.06 g / cm3 | I-Temp: 20 ° C; Cindezela: 760 Torr |
| I-PKA (ebikezelwe) | 11.82 ± 0.46 | Iningi le-acid temp: 25 ° C |
Ukumamatheka kwe-canonical O = c (i-con = 1c = cc = cc1) NC (C (O (O) cc (c (o) cc (c) (c) cc) c (c) (c) cc
I-Isomeric Smiles [C @ H] (c @@ H H] (CC (OC (C (C
Inchi
Inchi = 1s / c20h31no5 / C1-6-14 (2) 18 (16) 26) 21-19 (3,4) 26-20 (3,4) 26) 21-19 (3,4) 5) 21-19 (3,4) 5) 21-19 (3,4) 5) 21-19 (3,4) 5) 21-13-13-11-15-11-1-1-1 H3, (H, 21,24) / T14-, 16 +, 18- / M1 / S1 / S1
Ukhiye we-inchi
I-AZTSBAWJOLLRORIQ-LESCRADASA-N
| Izakhiwo zitholakala |
| Bitionalogical |
| Okuthakiweyo |
| Incekusana |
| Lipinski |
| Isakhiwo esihlobene |
| Impamba |
Bitionalogical
| Impahla | Thanda | Into efunekayo | Umthombo |
| Isici se-BioConCentration | I-616 | ph 1; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-617 | I-PH 2; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-617 | I-PH 3; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-617 | I-PH 4; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-617 | I-PH 5; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-617 | I-PH 6; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-617 | I-PH 7; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-617 | I-PH 8; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | I-616 | I-PH 9; Temp: 25 ° C | (1) ACD |
| Isici se-BioConCentration | 604 | ph 10; Temp: 25 ° C | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Okuthakiweyo
| Impahla | Thanda | Into efunekayo | Umthombo |
| Ibhola | I-3450 | ph 1; Temp: 25 ° C | (1) ACD |
| Ibhola | I-3460 | I-PH 2; Temp: 25 ° C | (1) ACD |
| Ibhola | I-3460 | I-PH 3; Temp: 25 ° C | (1) ACD |
| Ibhola | I-3460 | I-PH 4; Temp: 25 ° C | (1) ACD |
| Ibhola | I-3460 | I-PH 5; Temp: 25 ° C | (1) ACD |
| Ibhola | I-3460 | I-PH 6; Temp: 25 ° C | (1) ACD |
| Ibhola | I-3460 | I-PH 7; Temp: 25 ° C | (1) ACD |
| Ibhola | I-3460 | I-PH 8; Temp: 25 ° C | (1) ACD |
| Ibhola | I-3450 | I-PH 9; Temp: 25 ° C | (1) ACD |
| Ibhola | I-3390 | ph 10; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | I-3.97 | ph 1; Temp: 25 ° C | (1) ACD |
| Impahla | Thanda | Into efunekayo | Umthombo |
| into yokungena yogd | I-3.97 | I-PH 2; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | I-3.97 | I-PH 3; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | I-3.97 | I-PH 4; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | I-3.97 | I-PH 5; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | I-3.97 | I-PH 6; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | I-3.97 | I-PH 7; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | I-3.97 | I-PH 8; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | I-3.97 | I-PH 9; Temp: 25 ° C | (1) ACD |
| into yokungena yogd | 3.96 | ph 10; Temp: 25 ° C | (1) ACD |
| ngena ngemvume | 3.974 ± 0.543 | Temp: 25 ° C | (1) ACD |
| I-SAST ENTINSIC SOLUBLIC | 0.062 g / l | Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.062 g / l | ph 1; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.062 g / l | I-PH 2; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.062 g / l | I-PH 3; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.062 g / l | I-PH 4; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.062 g / l | I-PH 5; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.062 g / l | I-PH 6; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.062 g / l | I-PH 7; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.062 g / l | I-PH 8; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.062 g / l | I-PH 9; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.062 g / l | ph 10; Temp: 25 ° C | (1) ACD |
| Inqwaba ye-solubility | 0.062 g / l | Amanzi angaphekiwe ph 6.99; Temp: 25 ° C | (1) ACD |
| I-molar intrinsic soubility | 1.7 x 10-4 mol / l | Temp: 25 ° C | (1) ACD |
| Molar solility | 1.7 x 10-4 mol / l | ph 1; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.7 x 10-4 mol / l | I-PH 2; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.7 x 10-4 mol / l | I-PH 3; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.7 x 10-4 mol / l | I-PH 4; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.7 x 10-4 mol / l | I-PH 5; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.7 x 10-4 mol / l | I-PH 6; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.7 x 10-4 mol / l | I-PH 7; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.7 x 10-4 mol / l | I-PH 8; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.7 x 10-4 mol / l | I-PH 9; Temp: 25 ° C | (1) ACD |
| Impahla | Thanda | Into efunekayo | Umthombo |
| Molar solility | 1.7 x 10-4 mol / l | ph 10; Temp: 25 ° C | (1) ACD |
| Molar solility | 1.7 x 10-4 mol / l | Amanzi angaphekiwe ph 6.99; Temp: 25 ° C | (1) ACD |
| Isisindo molecular | 365.46 | ||
| i-pka | 11.82 ± 0.46 | Iningi le-acid temp: 25 ° C | (1) ACD |
| i-pka | -1.56 ± 0.70 | I-TEMP eyisisekelo Eyisisekelo: 25 ° C | (1) ACD |
| Ingcindezi ye-vapor | 5.56 x 10-11 Torm | Temp: 25 ° C | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Incekusana
| Impahla | Thanda | Into efunekayo | Umthombo |
| Incekusana | I-1.091 ± 0.06 g / cm3 | I-Temp: 20 ° C; Cindezela: 760 Torr | (1) ACD |
| Ivolumu ye-motal | 334.7 ± 3.0 CM3 / Mol | I-Temp: 20 ° C; Cindezela: 760 Torr | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Lipinski
| Impahla | Thanda | Into efunekayo | Umthombo |
| Amabhondi ajikeleze ngokukhululeka | 12 | (1) ACD | |
| Akwamukela | 6 | (1) ACD | |
| H | 2 | (1) ACD | |
| H Donor / ukwamukela inani | 8 | (1) ACD | |
| ngena ngemvume | 3.974 ± 0.543 | Temp: 25 ° C | (1) ACD |
| Isisindo molecular | 365.46 |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Isakhiwo esihlobene
| Impahla | Thanda | Into efunekayo | Umthombo |
| Indawo yePolar Surface | 84.9 A2 | (1) ACD | |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Impamba
| Impahla | Thanda | Into efunekayo | Umthombo |
| Iphuzu elibilayo | 504.1 ± 50.0 ° C | Cindezela: 760 Torr | (1) ACD |
| I-Enthalpy of Vaporization | 81.44 ± 3.0 KJ / Mol | Cindezela: 760 Torr | (1) ACD |
| I-flash point | 258.6 ± 30.1 ° C | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
I-Spectra iyatholakala
1h NMR
I-13c NMR
| Ukufingqwa | Isitatimende Sobungozi | Umthombo |
| H301 | Ubuthi uma bugwinya | Ukuhlukaniswa Kwamakhemikhali E-European Agency (ECHA) & I-Labeng Inventory - Ukuhlukaniswa Kwaziswa - Ukufakwa Kwamalebula - Izaziso ezivamile, Ukufakwa Kwamabhantshi - Ukufakwa Kwamalebula - Izaziso Ezibucayi kakhulu |
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