2-(2-BROMOETHYL)-2 5 5-TRIMETHYL-1 3-

Catalog No: FT-0659448

CAS No: 87842-52-2

Chemical Name: 2-(2-BROMOETHYL)-2 5 5-TRIMETHYL-1 3-
Molecular Formula: C9H17BrO2
Molecular Weight: 237.13
InChI Key: HSWLDQSQVWEZIG-UHFFFAOYSA-N
InChI: InChI=1S/C9H17BrO2/c1-8(2)6-11-9(3,4-5-10)12-7-8/h4-7H2,1-3H3

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:	2-(2-bromoethyl)-2,5,5-trimethyl-1,3-dioxane
Flash_Point:	204 °F
Melting_Point:	N/A
FW:	237.13400
Density:	1.26 g/mL at 25ºC(lit.)
CAS:	87842-52-2
Bolling_Point:	72-73ºC0.6 mm Hg(lit.)
MF:	C9H17BrO2

Molecular_Structure:	['五分子性质数据 ', '1 . Molar refractive index 5265 ', '2 . Molar volume （m3/mol）1961 ', '3 . Parachor （902K）4724 ', '4 . Surface tension 336 ', '5 . Dielectric constant N/A ', '6 偶极距（10 -24cm 3）N/A ', '7 . Polarizability 2087']
LogP:	2.56060
Flash_Point:	204 °F
Refractive_Index:	n20/D 1.470(lit.)
FW:	237.13400
Density:	1.26 g/mL at 25ºC(lit.)
Bolling_Point:	72-73ºC0.6 mm Hg(lit.)
Computational_Chemistry:	['1. XlogP :24 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 185 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :147 ', '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:	18.46000
MF:	C9H17BrO2
More_Info:	['1 . Appearance Colourless Liquid ', '2 . Density（g/mL,25℃）126 ', '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,008KPa）72-73 ', '7 . Refractive indexn20/D 1470 ', '8 . Flash point（ºC）956 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（Pa,20ºC）Unknow ', '12 . Saturated vapor pressure（KPa,20ºC）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']
Exact_Mass:	236.04100