Molecular Formula: 514.6
Formula Weight: C28H34O9
Inchl Key: KPDOJFFZKAUIOE-WNGDLQANSA-N
Inchl: InChI=1S/C28H34O9/c1-14(29)34-19-12-20(31)36-24(2,3)17-11-18(30)27(6)16(26(17,19)5)7-9-25(4)21(15-8-10-33-13-15)35-23(32)22-28(25,27)37-22/h8,10,13,16-17,19,21-22H,7,9,11-12H2,1-6H3/t16-,17+,19+,21+,22-,25+,26-,27+,28-/m1/s1

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Product_Name:	1-(Acetyloxy)-1,2-dihydroobacunoic Acid e-Lactone
Flash_Point:	351.6±31.5 °C
Melting_Point:	N/A
FW:	514.564
Density:	1.3±0.1 g/cm3
CAS:	1063-77-0
Bolling_Point:	657.7±55.0 °C at 760 mmHg
MF:	C28H34O9

Molecular_Structure:	['1 . Molar refractive index 12751 ', '2 . Molar volume （m3/mol）3860 ', '3 . Parachor （902K）10463 ', '4 . Surface tension 539 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10 -24cm 3）无可用 ', '7 . Polarizability 5055']
Flash_Point:	351.6±31.5 °C
Refractive_Index:	1.575
FW:	514.564
Density:	1.3±0.1 g/cm3
Bolling_Point:	657.7±55.0 °C at 760 mmHg
Computational_Chemistry:	['1 . XlogP 26 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 9 ', '4 . Rotatable Bond Count 3 ', '5 . Isotope Atom Count 2 ', '6 . TPSA 122 ', '7 . Heavy Atom Count 37 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 1080 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 9 ', '12 . Undefined Atom Stereocenter Count 0 ', '13 . Defined Bond Stereocenter Count 0 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1']
LogP:	2.47
PSA:	121.64000
MF:	C28H34O9
More_Info:	['1 . Appearance Unknow。 ', '2 . Density（g/cm3,25℃）Unknow ', '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,8mm）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:	0.0±2.0 mmHg at 25°C
Exact_Mass:	514.220276