![2-[carboxymethyl-[2-(2,6-diethylanilino)-2-oxoethyl]amino]acetic acid (CAS: 63245-28-3) - Chemical Structure and Molecular Formula](/static/img/prod_pic/FT-0766865.png "2-[carboxymethyl-[2-(2,6-diethylanilino)-2-oxoethyl]amino]acetic acid chemical structure")
2-[carboxymethyl-[2-(2,6-diethylanilino)-2-oxoethyl]amino]acetic acid
Catalog No: FT-0766865
CAS No: 63245-28-3
- Chemical Name: 2-[carboxymethyl-[2-(2,6-diethylanilino)-2-oxoethyl]amino]acetic acid
- Molecular Formula: C16H22N2O5
- Molecular Weight: 322.36
- InChI Key: WNIDXAKKFOKNEF-UHFFFAOYSA-N
- InChI: InChI=1S/C16H22N2O5/c1-3-11-6-5-7-12(4-2)16(11)17-13(19)8-18(9-14(20)21)10-15(22)23/h5-7H,3-4,8-10H2,1-2H3,(H,17,19)(H,20,21)(H,22,23)
| Assay | Pack Size | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Bolling_Point: | 582.5±50.0 °C at 760 mmHg |
|---|---|
| CAS: | 63245-28-3 |
| MF: | C16H22N2O5 |
| Density: | 1.3±0.1 g/cm3 |
| Melting_Point: | 187-190 °C |
| Product_Name: | etifenin |
| Flash_Point: | 306.1±30.1 °C |
| FW: | 322.356 |
| MF: | C16H22N2O5 |
|---|---|
| Density: | 1.3±0.1 g/cm3 |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :3 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :9 ', '5. Isotope Atom Count :3 ', '6. TPSA 107 ', '7. Heavy Atom Count :23 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :399 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| Melting_Point: | 187-190 °C |
| More_Info: | ['1 . Appearance White 粉末。 ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）187-190 ', '5 . Boiling point（ºC,Atmospheric pressure） Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Soluble in Water 。'] |
| Exact_Mass: | 322.152863 |
| Flash_Point: | 306.1±30.1 °C |
| Vapor_Pressure: | 0.0±1.7 mmHg at 25°C |
| PSA: | 106.94000 |
| Molecular_Structure: | ['1 . Molar refractive index 8500 ', '2 . Molar volume （m3/mol）2506 ', '3 . Parachor （902K）6926 ', '4 . Surface tension 582 ', '5 . Polarizability 3369'] |
| LogP: | 2.45 |
| Water_Solubility: | 可溶 |
| Bolling_Point: | 582.5±50.0 °C at 760 mmHg |
| FW: | 322.356 |
| Refractive_Index: | 1.593 |
| WGK_Germany: | 3 |
|---|---|
| Hazard_Codes: | Xi |
| RTECS: | AG9712500 |
| HS_Code: | 2924299090 |
| Risk_Statements(EU): | R36/37/38:Irritating to eyes, respiratory system and skin . |
| Safety_Statements: | 24/25 |
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