Phenyl trans-styryl sulfone (CAS: 5418-11-1) - Chemical Structure and Molecular Formula
Phenyl trans-styryl sulfone (CAS: 5418-11-1) - Chemical Structure Thumbnail

Phenyl trans-styryl sulfone

Catalog No:   FT-0676224

CAS No:   5418-11-1

  • Chemical Name:  Phenyl trans-styryl sulfone
  • Molecular Formula:  C14H12O2S
  • Molecular Weight:  244.31
  • InChI Key:  DNMCCXFLTURVLK-VAWYXSNFSA-N
  • InChI:  InChI=1S/C14H12O2S/c15-17(16,14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H/b12-11+
Product pricing and availability information
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
Product_Name: Phenyl trans-styryl sulfone
Flash_Point: 275.1ºC
Melting_Point: 74-75ºC(lit.)
FW: 244.30900
Density: 1.221g/cm3
CAS: 5418-11-1
Bolling_Point: 438.2ºC at 760mmHg
MF: C14H12O2S
Molecular_Structure: ['1. Molar refractive index 6945 ', '2. Molar volume 2000 ', '3. Parachor （902K）5248 ', '4. Surface tension 473 ', '5. Dielectric constant N/A ', '6. Polarizability 2753 ', '7. Single isotope mass 2440558 Da ', '8. Nominal mass 244 Da ', '9. Average mass 2443089 Da']
LogP: 4.21200
Flash_Point: 275.1ºC
FW: 244.30900
Density: 1.221g/cm3
Bolling_Point: 438.2ºC at 760mmHg
Computational_Chemistry: ['1. XlogP 31 ', '2. Hydrogen Bond Donor Count 0 ', '3. Hydrogen Bond Acceptor Count 2 ', '4. Rotatable Bond Count 3 ', '5. Isotope Atom Count N/A ', '6. TPSA 425 ', '7. Heavy Atom Count 17 ', '8. Topological Polar Surface Area 0 ', '9. Complexity 339 ', '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']
Melting_Point: 74-75ºC(lit.)
PSA: 42.52000
Exact_Mass: 244.05600
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）74-75 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºF）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']
MF: C14H12O2S
HS_Code: 2904100000

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