FT-0615816 CAS:338-03-4 chemical structure

3-HYDROXY-3-METHYL-4,4,4-TRIFLUOROBUTYRIC ACID

Name: 3-HYDROXY-3-METHYL-4,4,4-TRIFLUOROBUTYRIC ACID
Rating: 4.5 (11 reviews)

Catalog No: FT-0615816

CAS No: 338-03-4

Molecular Formula: 171.09
Formula Weight: C5H6F3O3-
Inchl Key: JCJGOWYCFRASTM-BYPYZUCNSA-M
Inchl: InChI=1S/C5H7F3O3/c1-4(11,2-3(9)10)5(6,7)8/h11H,2H2,1H3,(H,9,10)/p-1/t4-/m0/s1

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Melting_Point:	N/A
CAS:	338-03-4
MF:	C5H7F3O3
Flash_Point:	87-90°C/0.5mm
Product_Name:	4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid
Density:	1.3880
FW:	172.10200
Bolling_Point:	87 °C

Refractive_Index:	1.3880
Flash_Point:	87-90°C/0.5mm
LogP:	0.77440
Bolling_Point:	87 °C
FW:	172.10200
PSA:	57.53000
Computational_Chemistry:	['1. XlogP :04 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 575 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :165 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
MF:	C5H7F3O3
Exact_Mass:	172.03500
Molecular_Structure:	['1 . Molar refractive index 2873 ', '2 . Molar volume （m3/mol）1196 ', '3 . Parachor （902K）2883 ', '4 . Surface tension 337 ', '5 . Polarizability （10 -24cm 3）1139']
Density:	1.3880
More_Info:	['一物性数据 ', '. Appearance 不可用 ', '. Density（g/mL,25/4℃）13880 ', '. Relative vapor density（g/mL,Atmosphere =1）不可用 ', '. Melting point（ºC）不可用 ', '. Boiling point（ºC,Atmospheric pressure）87-90 ', '. Boiling point（ºC,52kPa）不可用 ', '. Refractive index13880 ', '. Flash point（ºC）87-90 ', '. Specific rotation（º）不可用 ', '. Spontaneous ignition point or ignition temperature（ºC）不可用 ', '. Vapor pressure（kPa,25ºC）不可用 ', '. Saturated vapor pressure（kPa,60ºC）不可用 ', '. Combustion heat（KJ/mol）不可用 ', '. Critical temperature（ºC）不可用 ', '. Critical pressure（KPa）不可用 ', '. Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不可用 ', '. Upper limit of explosion（%,V/V）不可用 ', '. Lower limit of explosion（%,V/V）不可用 ', '. Solubility 不可用']