

3-(2-THIENYL)-1-(P-TOLYL)-PROP-2-EN-1-ONE
Catalog No: FT-0605753
CAS No: 6028-89-3
- Molecular Formula: 228.31
- Formula Weight: C14H12OS
- Inchl Key: OUDDTWPBSXBJOY-CMDGGOBGSA-N
- Inchl: InChI=1S/C14H12OS/c1-11-4-6-12(7-5-11)14(15)9-8-13-3-2-10-16-13/h2-10H,1H3/b9-8+
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Product_Name: | 3-(2-thienyl)-1-(p-tolyl)-prop-2-en-1-one |
---|---|
Flash_Point: | 184.5ºC |
Melting_Point: | 75 °C |
FW: | 228.30900 |
Density: | 1.167g/cm3 |
CAS: | 6028-89-3 |
Bolling_Point: | 381.5ºC at 760 mmHg |
MF: | C14H12OS |
Molecular_Structure: | ['1 . Molar refractive index 7031 ', '2 . Molar volume (m3/mol)1955 ', '3 . Parachor (902K)5117 ', '4 . Surface tension 468 ', '5 . Polarizability 2787'] |
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Flash_Point: | 184.5ºC |
Refractive_Index: | 1.638 |
FW: | 228.30900 |
Density: | 1.167g/cm3 |
Bolling_Point: | 381.5ºC at 760 mmHg |
Computational_Chemistry: | ['1 . XlogP 38 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 1 ', '4 . Rotatable Bond Count 3 ', '5 . Isotope Atom Count ', '6 . TPSA 171 ', '7 . Heavy Atom Count 16 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 264 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 0 ', '12 . Undefined Atom Stereocenter Count 0 ', '13 . Defined Bond Stereocenter Count 1 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1'] |
LogP: | 3.95260 |
Melting_Point: | 75 °C |
PSA: | 45.31000 |
MF: | C14H12OS |
More_Info: | ['1 . Appearance Unknow ', '2 . Density(g/mL,25/4℃)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)75 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)Unknow ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,25ºC)Unknow ', '12 . Saturated vapor pressure(kPa,60ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)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 Unknow'] |
Exact_Mass: | 228.06100 |
Hazard_Codes: | Xn |
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RTECS: | UP8225000 |
Risk_Statements(EU): | R22:Harmful if swallowed. |
HS_Code: | 29322980 |
WGK_Germany: | 1 |
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