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rac-Clopidogrel-d4 Carboxylic Acid

4-(1',1''-BIPHENYL-4'-YL)-CYCLOHEXANONE

Catalog No: FT-0654509

CAS No: 78531-65-4

Chemical Name: 4-(1',1''-BIPHENYL-4'-YL)-CYCLOHEXANONE
Molecular Formula: C18H18O
Molecular Weight: 250.3
InChI Key: RUWXYHFRJXGBRY-UHFFFAOYSA-N
InChI: InChI=1S/C18H18O/c19-18-12-10-17(11-13-18)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-9,17H,10-13H2

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-phenylphenyl)cyclohexan-1-one
Flash_Point:	N/A
Melting_Point:	N/A
FW:	250.33500
Density:	N/A
CAS:	78531-65-4
Bolling_Point:	N/A
MF:	C18H18O

Computational_Chemistry:	['1. XlogP :38 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :2 ', '6. TPSA 171 ', '7. Heavy Atom Count :19 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :285 ', '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 7683 ', '2 . Molar volume （m3/mol）2324 ', '3 . Parachor （902K）5897 ', '4 . Surface tension 414 ', '5 . Dielectric constant ', '6 偶极距（10 -24cm 3） ', '7 . Polarizability 3046']
LogP:	4.58030
FW:	250.33500
More_Info:	['1 . Appearance White or 者淡Yellow 粉末。 ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）131-133 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）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（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 Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow。']
PSA:	17.07000
MF:	C18H18O
Exact_Mass:	250.13600