3-ACETYL-4,5-DIMETHYL-5-HYDROXY-1,5-DIHYDRO-2H-PYRROL-2-ONE
Catalog No: FT-0642374
CAS No: 98593-79-4
- Chemical Name: 3-ACETYL-4,5-DIMETHYL-5-HYDROXY-1,5-DIHYDRO-2H-PYRROL-2-ONE
- Molecular Formula: C8H11NO3
- Molecular Weight: 169.18
- InChI Key: DHZJIJWGYQXKFT-UHFFFAOYSA-N
- InChI: InChI=1S/C8H11NO3/c1-4-6(5(2)10)7(11)9-8(4,3)12/h12H,1-3H3,(H,9,11)
| 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 |
| Melting_Point: | 172-174ºC |
|---|---|
| CAS: | 98593-79-4 |
| MF: | C8H11NO3 |
| Flash_Point: | 222.4ºC |
| Product_Name: | 3-acetyl-4,5-dimethyl-5-hydroxy-1,5-dihydro-2h-pyrrol-2-one |
| Density: | 1.233 g/cm3 |
| FW: | 169.17800 |
| Bolling_Point: | 444.2ºC at 760 mmHg |
| Refractive_Index: | 1.519 |
|---|---|
| Flash_Point: | 222.4ºC |
| LogP: | 0.05900 |
| Bolling_Point: | 444.2ºC at 760 mmHg |
| PSA: | 66.40000 |
| Molecular_Structure: | ['1 . Molar refractive index 4163 ', '2 . Molar volume (m3/mol)1371 ', '3 . Parachor (902K)3528 ', '4 . Surface tension 437 ', '5 . Polarizability 1650'] |
| Computational_Chemistry: | ['1 . XlogP -09 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 1 ', '5 . TPSA 664 ', '6 . Heavy Atom Count 12 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 293 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 1 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1'] |
| Melting_Point: | 172-174ºC |
| MF: | C8H11NO3 |
| Exact_Mass: | 169.07400 |
| FW: | 169.17800 |
| Density: | 1.233 g/cm3 |
| More_Info: | ['1 . Appearance 无可用 ', '2 . Density(g/mL,25/4℃)无可用 ', '3 . Relative vapor density(g/mL,Atmosphere =1)无可用 ', '4 . Melting point(ºC)172-174 ', '5 . Boiling point(ºC,Atmospheric pressure)无可用 ', '6 . Boiling point(ºC,52kPa)无可用 ', '7 . Refractive index无可用 ', '8 . Flash point(ºC)无可用 ', '9 . Specific rotation(º)无可用 ', '10 . Spontaneous ignition point or ignition temperature(ºC)无可用 ', '11 . Vapor pressure(kPa,25ºC)无可用 ', '12 . Saturated vapor pressure(kPa,60ºC)无可用 ', '13 . Combustion heat(KJ/mol)无可用 ', '14 . Critical temperature(ºC)无可用 ', '15 . Critical pressure(KPa)无可用 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion(%,V/V)无可用 ', '18 . Lower limit of explosion(%,V/V)无可用 ', '19 . Solubility 无可用'] |
| Safety_Statements: | S24/25 |
|---|---|
| HS_Code: | 2933990090 |
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