tert-Butyl Hydrogen Phthalate

Catalog No: FT-0675968

CAS No: 33693-84-4

Chemical Name: tert-Butyl Hydrogen Phthalate
Molecular Formula: C12H14O4
Molecular Weight: 222.24
InChI Key: PBUQZKXKYSAJDO-UHFFFAOYSA-N
InChI: InChI=1S/C12H14O4/c1-12(2,3)16-11(15)9-7-5-4-6-8(9)10(13)14/h4-7H,1-3H3,(H,13,14)

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

Bolling_Point:	349.8ºC at 760mmHg
MF:	C12H14O4
Density:	1.173g/cm3
FW:	222.23700
Product_Name:	2-[(2-methylpropan-2-yl)oxycarbonyl]benzoic acid
CAS:	33693-84-4
Flash_Point:	131.8ºC
Melting_Point:	79-80°C

Bolling_Point:	349.8ºC at 760mmHg
LogP:	2.34010
More_Info:	['1 . Appearance White or 灰Yellow 粉末 ', '2 . Density（g/mL,20℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）84-88 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,KPa）Unknow ', '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（Pa,20ºC）Unknow ', '12 . Saturated vapor pressure（KPa,20ºC）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 Insoluble in Water ']
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 636 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :277 ', '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:	79-80°C
Exact_Mass:	222.08900
MF:	C12H14O4
Density:	1.173g/cm3
FW:	222.23700
PSA:	63.60000
Flash_Point:	131.8ºC