Ethyl 4-oxocyclohexanecarboxylate
Catalog No: FT-0618313
CAS No: 17159-79-4
- Molecular Formula: 170.21
- Formula Weight: C9H14O3
- Inchl Key: ZXYAWONOWHSQRU-UHFFFAOYSA-N
- Inchl: InChI=1S/C9H14O3/c1-2-12-9(11)7-3-5-8(10)6-4-7/h7H,2-6H2,1H3
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Melting_Point: | N/A |
|---|---|
| CAS: | 17159-79-4 |
| MF: | C9H14O3 |
| Flash_Point: | 103.8±25.4 °C |
| Product_Name: | Ethyl 4-oxocyclohexanecarboxylate |
| Density: | 1.1±0.1 g/cm3 |
| FW: | 170.206 |
| Bolling_Point: | 248.8±33.0 °C at 760 mmHg |
| Refractive_Index: | 1.465 |
|---|---|
| Vapor_Pressure: | 0.0±0.5 mmHg at 25°C |
| Flash_Point: | 103.8±25.4 °C |
| LogP: | 0.74 |
| Bolling_Point: | 248.8±33.0 °C at 760 mmHg |
| Water_Solubility: | insoluble |
| PSA: | 43.37000 |
| Molecular_Structure: | ['1 . Molar refractive index 4338 ', '2 . Molar volume （m3/mol）1570 ', '3 . Parachor （902K）3895 ', '4 表面张力（30 dyne/cm）378 ', '5 . Polarizability （05 10 -24cm 3）1719'] |
| Computational_Chemistry: | ['1. XlogP :06 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :2 ', '6. TPSA 434 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :176 ', '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'] |
| MF: | C9H14O3 |
| Exact_Mass: | 170.094299 |
| FW: | 170.206 |
| Density: | 1.1±0.1 g/cm3 |
| More_Info: | ['1 . Appearance 不确定 ', '2 . Density（g/mL,25/4℃）1068 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 4 . Melting point（ ºC ） 不确定 5 . Boiling point（ ºC, Atmospheric pressure）不确定 ', '6 . Boiling point（ºC, 40mmHg）150-152 ', '7 . Refractive index1461 ', '8 . Flash point（ºF）>230 ', '9 . Specific rotation（º）不确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,25ºC）不确定 ', '12 . Saturated vapor pressure（kPa,60ºC）不确定 ', '13 . Combustion heat（KJ/mol）不确定 ', '14 . Critical temperature（ºC）不确定 ', '15 . Critical pressure（KPa）不确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion（%,V/V）不确定 ', '18 . Lower limit of explosion（%,V/V）不确定 ', '19 . Solubility Insoluble in Water '] |
| Risk_Statements(EU): | R36/37/38 |
|---|---|
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| RIDADR: | NONH for all modes of transport |
| Hazard_Codes: | Xi:Irritant; |
| HS_Code: | 2918300090 |
| Safety_Statements: | S26-S36-S37/39 |
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