ETHYL 3,4-DIFLUOROBENZOATE

Catalog No: FT-0626006

CAS No: 144267-96-9

Chemical Name: ETHYL 3,4-DIFLUOROBENZOATE
Molecular Formula: C9H8F2O2
Molecular Weight: 186.15
InChI Key: NKIWNSXGZXESSM-UHFFFAOYSA-N
InChI: InChI=1S/C9H8F2O2/c1-2-13-9(12)6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Product_Name:	Ethyl 3,4-difluorobenzoate
Flash_Point:	86.6±18.1 °C
Melting_Point:	N/A
FW:	186.155
Density:	1.2±0.1 g/cm3
CAS:	144267-96-9
Bolling_Point:	223.4±25.0 °C at 760 mmHg
MF:	C9H8F2O2

Molecular_Structure:	['1. Molar refractive index 4264 ', '2. Molar volume 1522 ', '3. Parachor （902K）3661 ', '4. Surface tension 334 ', '5. Dielectric constant N/A ', '6. Polarizability 169 ', '7. Single isotope mass 186049236 Da ', '8. Nominal mass 186 Da ', '9. Average mass 1861554 Da']
LogP:	2.97
Flash_Point:	86.6±18.1 °C
Refractive_Index:	1.472
FW:	186.155
Density:	1.2±0.1 g/cm3
Bolling_Point:	223.4±25.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :185 ', '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']
PSA:	26.30000
MF:	C9H8F2O2
More_Info:	['1 . Appearance ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC） ', '5 . Boiling point（ 15mm ºC）96 ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash pointUnknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）不适用的 ', '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']
Vapor_Pressure:	0.1±0.4 mmHg at 25°C
Exact_Mass:	186.049240