METHYL 4-IODO-3-METHYLBENZOATE


Catalog No:   FT-0647533

CAS No:   5471-81-8

  • Molecular Formula:  276.07
  • Formula Weight: C9H9IO2
  • Inchl Key: HCSGWQGKCVQIRM-UHFFFAOYSA-N
  • Inchl: InChI=1S/C9H9IO2/c1-6-5-7(9(11)12-2)3-4-8(6)10/h3-5H,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
Bolling_Point: 299.0±28.0 °C at 760 mmHg
MF: C9H9IO2
Density: 1.7±0.1 g/cm3
FW: 276.071
Product_Name: Methyl 4-iodo-3-methylbenzoate
CAS: 5471-81-8
Flash_Point: 134.6±24.0 °C
Melting_Point: 59-62ºC
Bolling_Point: 299.0±28.0 °C at 760 mmHg
Vapor_Pressure: 0.0±0.6 mmHg at 25°C
LogP: 3.86
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)59-62 ', '5 . Boiling point(ºC,Atmospheric pressure)106 ', '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']
Computational_Chemistry: ['1. XlogP :28 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :170 ', '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: 59-62ºC
Exact_Mass: 275.964722
MF: C9H9IO2
Density: 1.7±0.1 g/cm3
Refractive_Index: 1.588
PSA: 26.30000
Flash_Point: 134.6±24.0 °C
Molecular_Structure: ['1 . Molar refractive index 5575 ', '2 . Molar volume (m3/mol)1656 ', '3 . Parachor (902K)4253 ', '4 . Surface tension 434 ', '5 . Polarizability (10 -24cm 3)2210']
FW: 276.071
Safety_Statements: S24/25
HS_Code: 2916399090

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