

Diethyl phenylmalonate
Catalog No: FT-0624800
CAS No: 83-13-6
- Molecular Formula: 236.26
- Formula Weight: C13H16O4
- Inchl Key: FGYDHYCFHBSNPE-UHFFFAOYSA-N
- Inchl: InChI=1S/C13H16O4/c1-3-16-12(14)11(13(15)17-4-2)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Melting_Point: | 16 °C(lit.) |
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CAS: | 83-13-6 |
MF: | C13H16O4 |
Flash_Point: | 141.8±20.7 °C |
Product_Name: | Diethyl phenylmalonate |
Density: | 1.1±0.1 g/cm3 |
FW: | 236.264 |
Bolling_Point: | 301.0±22.0 °C at 760 mmHg |
Refractive_Index: | 1.500 |
---|---|
Vapor_Pressure: | 0.0±0.6 mmHg at 25°C |
Flash_Point: | 141.8±20.7 °C |
LogP: | 2.71 |
Bolling_Point: | 301.0±22.0 °C at 760 mmHg |
Water_Solubility: | immiscible |
FW: | 236.264 |
PSA: | 52.60000 |
Computational_Chemistry: | ['1. XlogP :26 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :7 ', '5. Isotope Atom Count :N/A ', '6. TPSA 526 ', '7. Heavy Atom Count :17 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :238 ', '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'] |
Melting_Point: | 16 °C(lit.) |
MF: | C13H16O4 |
Exact_Mass: | 236.104858 |
Molecular_Structure: | ['1 . Molar refractive index 6251 ', '2 . Molar volume (m3/mol)2124 ', '3 . Parachor (902K)5309 ', '4 . Surface tension 389 ', '5 . Polarizability 2478'] |
Density: | 1.1±0.1 g/cm3 |
More_Info: | ['1 . Appearance Colourless to 淡Yellow 透明油状Liquid ', '2 . Density(g/mL,25/4℃)1095 ', '3 . Relative vapor density(g/mL,Atmosphere =1)不确定 ', '4 . Melting point(ºC)16-17 ', '5 . Boiling point(ºC,Atmospheric pressure)170-172 ', '6 . Boiling point(ºC,52kPa)不确定 ', '7 . Refractive index14903-14923 ', '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 Insoluble in Water ,Soluble in Ethanol '] |
RIDADR: | NONH for all modes of transport |
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Safety_Statements: | S23-S24/25 |
HS_Code: | 2942000000 |
WGK_Germany: | 3 |
Personal_Protective_Equipment: | Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US) |
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