3-(3-FLUOROPHENYL)PROPIONIC ACID


Catalog No:   FT-0632160

CAS No:   458-45-7

  • Chemical Name:  3-(3-FLUOROPHENYL)PROPIONIC ACID
  • Molecular Formula:  C9H9FO2
  • Molecular Weight:  168.16
  • InChI Key:  UBLMRADOKLXLCD-UHFFFAOYSA-N
  • InChI:  InChI=1S/C9H9FO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6H,4-5H2,(H,11,12)

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
Symbol: Danger
FW: 168.165
Density: 1.2±0.1 g/cm3
CAS: 458-45-7
Bolling_Point: 270.6±15.0 °C at 760 mmHg
Product_Name: 3-(3-Fluorophenyl)propanoic acid
Melting_Point: 43-47ºC
Flash_Point: 117.4±20.4 °C
MF: C9H9FO2
Molecular_Structure: ['1 . Molar refractive index 4199 ', '2 . Molar volume (m3/mol)1375 ', '3 . Parachor (902K)3525 ', '4 . Surface tension 431 ', '5 . Polarizability (10 -24cm 3)1664']
Flash_Point: 117.4±20.4 °C
Refractive_Index: 1.522
FW: 168.165
Density: 1.2±0.1 g/cm3
Bolling_Point: 270.6±15.0 °C at 760 mmHg
Computational_Chemistry: ['1. XlogP :18 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :159 ', '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']
LogP: 1.89
Melting_Point: 43-47ºC
PSA: 37.30000
MF: C9H9FO2
More_Info: ['1 . Appearance White 晶体 ', '2 . Density(g/ m3,25/4℃)Unknow ', '3 . Relative vapor density(g/cm3,Atmosphere =1)Unknow ', '4 . Melting point(ºC)43-47 ', '5 . Boiling point(ºC,Atmospheric pressure)125 ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºF)230 ', '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']
Vapor_Pressure: 0.0±0.6 mmHg at 25°C
Exact_Mass: 168.058655
Personal_Protective_Equipment: dust mask type N95 (US);Eyeshields;Faceshields;Gloves
Hazard_Codes: Xn:Harmful;
Risk_Statements(EU): R22;R37/38;R41
Safety_Statements: S26-S36
Symbol: Danger
Warning_Statement: P261-P280-P305 + P351 + P338
RIDADR: NONH for all modes of transport
HS_Code: 2916399090
WGK_Germany: 2

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