5-methylhex-5-en-2-one
Catalog No: FT-0692786
CAS No: 3240-09-3
- Chemical Name: 5-methylhex-5-en-2-one
- Molecular Formula: C7H12O
- Molecular Weight: 112.17 g/mol
- InChI Key: VBCIOOKAKHGVMI-UHFFFAOYSA-N
- InChI: InChI=1S/C7H12O/c1-6(2)4-5-7(3)8/h1,4-5H2,2-3H3
| 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: | GHS02, GHS05, GHS07 |
|---|---|
| CAS: | 3240-09-3 |
| Flash_Point: | 38.7ºC |
| Product_Name: | 5-methylhex-5-en-2-one |
| Bolling_Point: | 147.3ºC at 760mmHg |
| FW: | 112.17000 |
| Melting_Point: | N/A |
| MF: | C7H12O |
| Density: | 0.824g/cm3 |
| Refractive_Index: | n20/D 1.431(lit.) |
|---|---|
| Flash_Point: | 38.7ºC |
| LogP: | 1.93170 |
| Bolling_Point: | 147.3ºC at 760mmHg |
| FW: | 112.17000 |
| PSA: | 17.07000 |
| Computational_Chemistry: | ['1 . XlogP 16 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 15 ', '4 . Rotatable Bond Count 3 ', '5 . Isotope Atom Count 3 ', '6 . TPSA 171 ', '7 . Heavy Atom Count 8 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 103 ', '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: | C7H12O |
| Exact_Mass: | 112.08900 |
| Molecular_Structure: | ['1 . Molar refractive index 3407 ', '2 . Molar volume 1360 ', '3 . Parachor （902K）3008 ', '4 . Surface tension 238 ', '5 . Dielectric constant （F/m）无可用 ', '6 偶极距（D）无可用 ', '7 . Polarizability 1350'] |
| Density: | 0.824g/cm3 |
| More_Info: | ['1 . Appearance Unknow ', '2 . Density（g/mLat 25°C）0846 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）150 ', '6 . Boiling point（ºC,3mmHg）Unknow ', '7 . Refractive index（n20/D）1431 ', '8 . Flash point（ºC）422 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,37ºC）Unknow ', '12 . Saturated vapor pressure（kPa,1144 ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（MPa）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 易Soluble in 丙酮 Ethyl ether and Ethanol 。'] |
| Hazard_Class: | 3.2 |
|---|---|
| Symbol: | GHS02, GHS05, GHS07 |
| Risk_Statements(EU): | 10-22-41 |
| HS_Code: | 2914190090 |
| Packing_Group: | III |
| RIDADR: | UN 1224 3/PG 3 |
| Hazard_Codes: | Xn: Harmful; |
| Warning_Statement: | P280-P305 + P351 + P338 |
| Safety_Statements: | H226-H302-H318 |
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