4-Isopropylbenzoic acid

Catalog No: FT-0624113

CAS No: 536-66-3

Chemical Name: 4-Isopropylbenzoic acid
Molecular Formula: C10H12O2
Molecular Weight: 164.2
InChI Key: CKMXAIVXVKGGFM-UHFFFAOYSA-N
InChI: InChI=1S/C10H12O2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h3-7H,1-2H3,(H,11,12)

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

FW:	164.201
CAS:	536-66-3
Flash_Point:	128.1±16.2 °C
MF:	C10H12O2
Symbol:	Warning
Bolling_Point:	271.8±19.0 °C at 760 mmHg
Melting_Point:	117-120 °C(lit.)
Product_Name:	4-Isopropylbenzoic acid
Density:	1.1±0.1 g/cm3

FW:	164.201
MF:	C10H12O2
Water_Solubility:	sparingly soluble
Refractive_Index:	1.535
Vapor_Pressure:	0.0±0.6 mmHg at 25°C
Bolling_Point:	271.8±19.0 °C at 760 mmHg
Exact_Mass:	164.083725
PSA:	37.30000
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :3 ', '6. TPSA 373 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :155 ', '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']
Molecular_Structure:	['1 . Molar refractive index 4736 ', '2 . Molar volume （m3/mol）1520 ', '3 . Parachor （902K）3844 ', '4 . Surface tension 408 ', '5 . Polarizability 1877']
LogP:	3.23
Melting_Point:	117-120 °C(lit.)
Flash_Point:	128.1±16.2 °C
Density:	1.1±0.1 g/cm3
More_Info:	['1 . Appearance White 粉末 ', '2 . Density（g/ cm3, 16 ℃ ）1162 ', '3 . Relative vapor density（g/cm3,Atmosphere =1）Unknow ', '4 . Melting point（ºC）115-117 ', '5 . Boiling point（ºC,Atmospheric pressure）272 ', '6 . Boiling point（ºC,8kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºF）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mm Hg,20ºC）Unknow ', '12 . Saturated vapor pressure（kPa,551ºC）Unknow ', '13 . Combustion heat（KJ/mol）539 ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 323 ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Soluble in Water ']

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
RTECS:	DH3850500
HS_Code:	2916399090
Symbol:	Warning
Risk_Statements(EU):	R20/21/22;R36/37/38
WGK_Germany:	3
Warning_Statement:	P261-P305 + P351 + P338
Safety_Statements:	H315-H319-H335
RIDADR:	NONH for all modes of transport
Hazard_Codes:	Xn:Harmful