Molecular Formula: 297.66
Formula Weight: C9H11ClF3N5O
Inchl Key: VAWGZGSCMHDUCU-UHFFFAOYSA-N
Inchl: InChI=1S/C9H10F3N5O.ClH/c10-9(11,12)18-6-3-1-5(2-4-6)16-8(15)17-7(13)14;/h1-4H,(H6,13,14,15,16,17);1H

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

Product_Name:	(3-(trifluoromethoxy)phenyl)acetone
Flash_Point:	81.9ºC
Melting_Point:	207-212ºC(lit.)
FW:	297.66500
Density:	1.237g/cm3
CAS:	42823-09-6
Bolling_Point:	215.3ºC at 760 mmHg
MF:	C9H11ClF3N5O

Molecular_Structure:	['1 . Molar refractive index 7933 ', '2 . Molar volume 2455 ', '3 . Parachor （902K）6274 ', '4 . Surface tension 426 ', '5 . Polarizability 3144 ', '6 . Dielectric constant 未确定']
Flash_Point:	81.9ºC
Refractive_Index:	1.452
FW:	297.66500
Density:	1.237g/cm3
Bolling_Point:	215.3ºC at 760 mmHg
Computational_Chemistry:	['1 . XlogP 32 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 6 ', '5 . TPSA 341 ', '6 . Heavy Atom Count 20 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 322 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 1 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
LogP:	3.58060
Melting_Point:	207-212ºC(lit.)
PSA:	107.01000
MF:	C9H11ClF3N5O
More_Info:	['1 . Appearance Solid ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）207-212 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用']
Exact_Mass:	297.06000