Hexyl 3-ketobutyrate

Catalog No: FT-0693396

CAS No: 13562-84-0

Chemical Name: Hexyl 3-ketobutyrate
Molecular Formula: C10H18O3
Molecular Weight: 186.25 g/mol
InChI Key: QNZLAXONNWOLJY-UHFFFAOYSA-N
InChI: InChI=1S/C10H18O3/c1-3-4-5-6-7-13-10(12)8-9(2)11/h3-8H2,1-2H3

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:	Hexyl Acetoacetate
Flash_Point:	92.3ºC
Melting_Point:	N/A
FW:	186.24800
Density:	0.96 g/cm3
CAS:	13562-84-0
Bolling_Point:	239ºC
MF:	C10H18O3

Molecular_Structure:	['1 . Molar refractive index 5018 ', '2 . Molar volume （m3/mol）1942 ', '3 . Parachor （902K）4597 ', '4 . Surface tension 314 ', '5 . Polarizability 1989']
LogP:	2.08900
Flash_Point:	92.3ºC
Refractive_Index:	1.43
FW:	186.24800
Density:	0.96 g/cm3
Bolling_Point:	239ºC
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :8 ', '5. Isotope Atom Count :5 ', '6. TPSA 434 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :164 ', '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']
PSA:	43.37000
MF:	C10H18O3
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL,25/4℃）096 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）239 ', '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']
Vapor_Pressure:	0.0586mmHg at 25°C
Exact_Mass:	186.12600