3-BENZYLIDENE-2,4-PENTANEDIONE
Catalog No: FT-0615097
CAS No: 4335-90-4
- Molecular Formula: 188.22
- Formula Weight: C12H12O2
- Inchl Key: NYRGMNMVISROGJ-UHFFFAOYSA-N
- Inchl: InChI=1S/C12H12O2/c1-9(13)12(10(2)14)8-11-6-4-3-5-7-11/h3-8H,1-2H3
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Symbol: | Warning |
|---|---|
| FW: | 188.22200 |
| Density: | 1.081 g/mL at 25 °C(lit.) |
| CAS: | 4335-90-4 |
| Bolling_Point: | 185-188 °C15 mm Hg(lit.) |
| Product_Name: | 3-benzylidenepentane-2,4-dione |
| Melting_Point: | N/A |
| Flash_Point: | >230 °F |
| MF: | C12H12O2 |
| Molecular_Structure: | ['1 . Molar refractive index 5594 ', '2 . Molar volume （m3/mol）1739 ', '3 . Parachor （902K）4359 ', '4 . Surface tension 394 ', '5 . Polarizability （10 -24cm 3）2217'] |
|---|---|
| LogP: | 2.24800 |
| Flash_Point: | >230 °F |
| Refractive_Index: | n20/D 1.583(lit.) |
| FW: | 188.22200 |
| Density: | 1.081 g/mL at 25 °C(lit.) |
| Bolling_Point: | 185-188 °C15 mm Hg(lit.) |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :3 ', '6. TPSA 341 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :242 ', '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'] |
| PSA: | 34.14000 |
| MF: | C12H12O2 |
| More_Info: | ['1 . Appearance Colourless or 浅Yellow Liquid ', '2 . Density（g/mL , 25℃） 1081 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）不确定 ', '5 . Boiling point（ºC）不确定 ', '6 . Boiling point（ºC, 15 mmHg）185-188 ', '7 . Refractive index1583 ', '8 . Flash point（°F）>230 ', '9 . Specific rotation（º, C=1, 氯仿）不确定 ', '10 燃点（ºC）>110 ', '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 ，能与 Ethanol and 丙酮混合'] |
| Exact_Mass: | 188.08400 |
| Hazard_Codes: | Xi |
|---|---|
| Symbol: | Warning |
| Warning_Statement: | P261-P305 + P351 + P338 |
| HS_Code: | 2914399090 |
| Personal_Protective_Equipment: | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| RTECS: | SA1930000 |
| Risk_Statements(EU): | 36/37/38 |
| Safety_Statements: | S26-S36 |
| RIDADR: | NONH for all modes of transport |
| WGK_Germany: | 3 |
