Methyl 3-bromobenzoate


Catalog No:   FT-0615205

CAS No:   618-89-3

  • Molecular Formula:  215.04
  • Formula Weight: C8H7BrO2
  • Inchl Key: KMFJVYMFCAIRAN-UHFFFAOYSA-N
  • Inchl: InChI=1S/C8H7BrO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3

Assay Pack Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Flash_Point: 101.6±19.8 °C
FW: 215.044
Bolling_Point: 244.4±13.0 °C at 760 mmHg
Product_Name: Methyl 3-bromobenzoate
CAS: 618-89-3
MF: C8H7BrO2
Melting_Point: 31-33 °C(lit.)
Density: 1.5±0.1 g/cm3
PSA: 26.30000
Bolling_Point: 244.4±13.0 °C at 760 mmHg
Molecular_Structure: ['五分子性质数据 ', '1 . Molar refractive index 4571 ', '2 . Molar volume (m3/mol)1435 ', '3 . Parachor (902K)3626 ', '4 . Surface tension 407 ', '5 . Polarizability (10 -24cm 3)1812']
LogP: 2.88
More_Info: ['一物性数据 ', '1 . Appearance 淡Yellow 晶体。 ', '2 . DensityUnknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)31-34℃。 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,52kPa) 139-140℃。 ', '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 Soluble in Ethyl ether Ethanol 乙酸乙酯。']
MF: C8H7BrO2
Computational_Chemistry: ['1. XlogP :N/A ', '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 :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :147 ', '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: 31-33 °C(lit.)
Refractive_Index: 1.550
Flash_Point: 101.6±19.8 °C
FW: 215.044
Exact_Mass: 213.962936
Vapor_Pressure: 0.0±0.5 mmHg at 25°C
Density: 1.5±0.1 g/cm3
Hazard_Codes: Xi:Irritant;
WGK_Germany: 3
Personal_Protective_Equipment: Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
HS_Code: 2916399090
Risk_Statements(EU): R36/37/38
Safety_Statements: S37/39-S26
RIDADR: NONH for all modes of transport

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