2-(BETA-CYANOETHYL)CYCLOHEXANONE
Catalog No: FT-0635366
CAS No: 4594-78-9
- Chemical Name: 2-(BETA-CYANOETHYL)CYCLOHEXANONE
- Molecular Formula: C9H13NO
- Molecular Weight: 151.21
- InChI Key: SPTVCXKSSRBTMN-UHFFFAOYSA-N
- InChI: InChI=1S/C9H13NO/c10-7-3-5-8-4-1-2-6-9(8)11/h8H,1-6H2
| 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 |
| Symbol: | GHS07 |
|---|---|
| CAS: | 4594-78-9 |
| Flash_Point: | 135.6ºC |
| Product_Name: | 2-(beta-cyanoethyl)cyclohexanone |
| Bolling_Point: | 138-142 °C (10 mmHg) |
| FW: | 151.20600 |
| Melting_Point: | N/A |
| MF: | C9H13NO |
| Density: | 1.024 g/mL at 20 °C(lit.) |
| Refractive_Index: | n20/D 1.474 |
|---|---|
| Flash_Point: | 135.6ºC |
| LogP: | 2.04948 |
| Bolling_Point: | 138-142 °C (10 mmHg) |
| FW: | 151.20600 |
| PSA: | 40.86000 |
| Computational_Chemistry: | ['1. XlogP :1 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :3 ', '6. TPSA 409 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :189 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| MF: | C9H13NO |
| Exact_Mass: | 151.10000 |
| Molecular_Structure: | ['1 . Molar refractive index 4167 ', '2 . Molar volume （m3/mol）1504 ', '3 . Parachor （902K）3734 ', '4 . Surface tension 379 ', '5 . Polarizability （10 -24cm 3）1652'] |
| Density: | 1.024 g/mL at 20 °C(lit.) |
| More_Info: | ['1 . Appearance Yellow Liquid ', '2 . Density不确定 ', '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,9mmHg）不确定 ', '7 . Refractive index不确定 ', '8 . Flash point（ºC）不确定 ', '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 不确定'] |
| Symbol: | GHS07 |
|---|---|
| RIDADR: | UN3276 |
| HS_Code: | 2926909090 |
| Packing_Group: | III |
| Hazard_Class: | 6.1 |
| Risk_Statements(EU): | R20/21 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard_Codes: | Xn:Harmful; |
| Warning_Statement: | P280 |
| Safety_Statements: | H302-H312-H332 |
