Chemical Name: 4-(4-n-Pentylphenyl)benzoic acid
Molecular Formula: C18H20O2
Molecular Weight: 268.3
InChI Key: VRGQQLFRUKMDSW-UHFFFAOYSA-N
InChI: InChI=1S/C18H20O2/c1-2-3-4-5-14-6-8-15(9-7-14)16-10-12-17(13-11-16)18(19)20/h6-13H,2-5H2,1H3,(H,19,20)

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:	4-(4-pentylphenyl)benzoic acid
Flash_Point:	199ºC
Melting_Point:	134-138 °C(lit.)
FW:	268.35000
Density:	1.075g/cm3
CAS:	59662-47-4
Bolling_Point:	425.6ºC at 760 mmHg
MF:	C18H20O2

Flash_Point:	199ºC
Refractive_Index:	1.564
FW:	268.35000
Density:	1.075g/cm3
Bolling_Point:	425.6ºC at 760 mmHg
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :20 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :284 ', '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:	4.78450
Melting_Point:	134-138 °C(lit.)
PSA:	37.30000
MF:	C18H20O2
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/cm3 ）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index（°）Unknow ', '8 . Flash point（ºC，2mmHg）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 （25℃）Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility (mg/mL，)Water Unknow']
Exact_Mass:	268.14600

Hazard_Codes:	Xi
Risk_Statements(EU):	R36/37/38:Irritating to eyes, respiratory system and skin .
HS_Code:	2916399090
WGK_Germany:	3
Safety_Statements:	S26-S36