FT-0606947 CAS:6963-44-6 chemical structure

1,5-Diacetoxypentane

Name: 1,5-Diacetoxypentane
Rating: 4.5 (11 reviews)

Catalog No: FT-0606947

CAS No: 6963-44-6

Molecular Formula: 188.22
Formula Weight: C9H16O4
Inchl Key: PIJBVCVBCQOWMM-UHFFFAOYSA-N
Inchl: InChI=1S/C9H16O4/c1-8(10)12-6-4-3-5-7-13-9(2)11/h3-7H2,1-2H3

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:	6963-44-6
MF:	C9H16O4
Flash_Point:	>230 °F
Product_Name:	1,5-Diacetoxypentane
Density:	1.033 g/mL at 25 °C(lit.)
FW:	188.22100
Bolling_Point:	122 °C12 mm Hg(lit.)

Refractive_Index:	n20/D 1.427(lit.)
Flash_Point:	>230 °F
LogP:	1.28290
Bolling_Point:	122 °C12 mm Hg(lit.)
FW:	188.22100
PSA:	52.60000
Computational_Chemistry:	['1. XlogP :11 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :8 ', '5. Isotope Atom Count :N/A ', '6. TPSA 526 ', '7. Heavy Atom Count :13 ', '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']
MF:	C9H16O4
Exact_Mass:	188.10500
Molecular_Structure:	['1 . Molar refractive index 4729 ', '2 . Molar volume 1840 ', '3 . Parachor （902K）4396 ', '4 . Surface tension 325 ', '5 . Polarizability 1874']
Density:	1.033 g/mL at 25 °C(lit.)
More_Info:	['一物性数据 ', '. Appearance 不可用 ', '. Density（g/mL,25/4℃）1033 ', '. Relative vapor density（g/mL,Atmosphere =1）不可用 ', '. Melting point（ºC）2 ', '. Boiling point（ºC,Atmospheric pressure）12212 ', '常温. Refractive index（n25）14257 ', '. Refractive index不可用 ', '. Flash point（ºC）>230℉ ', '. Specific rotation（º）不可用 ', '. Spontaneous ignition point or ignition temperature（ºC）不可用 ', '. Vapor pressure（kPa,25ºC）不可用 ', '. Saturated vapor pressure（kPa,60ºC）不可用 ', '. Combustion heat（KJ/mol）不可用 ', '. Critical temperature（ºC）不可用 ', '. Critical pressure（KPa）不可用 ', '. Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不可用 ', '. Upper limit of explosion（%,V/V）不可用 ', '. Lower limit of explosion（%,V/V）不可用 ', '. Solubility 不可用']