MALONIC ACID MONO-4-NITROBENZYL ESTER MAGNESIUM SALT

Catalog No: FT-0641560

CAS No: 75321-09-4

Chemical Name: MALONIC ACID MONO-4-NITROBENZYL ESTER MAGNESIUM SALT
Molecular Formula: C20H18MgN2O13
Molecular Weight: 518.7 g/mol
InChI Key: YBYPQJVVTJGLIW-UHFFFAOYSA-L
InChI: InChI=1S/2C10H9NO6.Mg.H2O/c2*12-9(13)5-10(14)17-6-7-1-3-8(4-2-7)11(15)16;;/h2*1-4H,5-6H2,(H,12,13);;1H2/q;;+2;/p-2

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

Base Information
Chemical Information

Product_Name:	Magnesium 4-Nitrobenzyl Malonate Hydrate
Flash_Point:	229.5ºC
Melting_Point:	N/A
FW:	500.65200
Density:	N/A
CAS:	75321-09-4
Bolling_Point:	455.8ºC at 760 mmHg
MF:	C20H16MgN2O12

LogP:	0.60240
Computational_Chemistry:	['1 . XlogP 26 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 5 ', '5 . TPSA 571 ', '6 . Heavy Atom Count 21 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 472 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
FW:	500.65200
PSA:	224.50000
Flash_Point:	229.5ºC
MF:	C20H16MgN2O12
More_Info:	['1 . Appearance 类White 粉末。 ', '2 . Density（g/mL,25/4℃）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,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 。']
Bolling_Point:	455.8ºC at 760 mmHg
Exact_Mass:	500.05500