FT-0617080 CAS:1073-13-8 chemical structure

4,4-DIMETHYL-2-CYCLOHEXEN-1-ONE

Catalog No: FT-0617080

CAS No: 1073-13-8

Molecular Formula: 124.18
Formula Weight: C8H12O
Inchl Key: HAUNPYVLVAIUOO-UHFFFAOYSA-N
Inchl: InChI=1S/C8H12O/c1-8(2)5-3-7(9)4-6-8/h3,5H,4,6H2,1-2H3

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:	1073-13-8
MF:	C8H12O
Flash_Point:	64.4±0.0 °C
Product_Name:	4,4-Dimethyl-2-cyclohexen-1-one
Density:	0.9±0.1 g/cm3
FW:	124.180
Bolling_Point:	173.5±0.0 °C at 760 mmHg

Refractive_Index:	1.458
Vapor_Pressure:	1.3±0.3 mmHg at 25°C
Flash_Point:	64.4±0.0 °C
LogP:	1.48
Bolling_Point:	173.5±0.0 °C at 760 mmHg
FW:	124.180
PSA:	17.07000
Computational_Chemistry:	['1. XlogP :18 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :2 ', '6. TPSA 171 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :154 ', '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']
MF:	C8H12O
Exact_Mass:	124.088814
Molecular_Structure:	['1 . Molar refractive index 3672 ', '2 . Molar volume 1346 ', '3 . Parachor （902K）3098 ', '4 . Surface tension 280 ', '5 . Dielectric constant 不可用 ', '6 偶极距（10-24cm3）无可用 ', '7 . Polarizability 1455']
Density:	0.9±0.1 g/cm3
More_Info:	['1 . Appearance Unknow。 ', '2 . Density（g/mL,25℃）0944 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,20mmHg）72-735(2666pa) ', '7 . Refractive index(n 20/D) 1473 ', '8 . Flash point（ºC）64 ', '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']