sodium;2,4-dimethylbenzenesulfonate

Catalog No: FT-0711964

CAS No: 827-21-4

Chemical Name: sodium;2,4-dimethylbenzenesulfonate
Molecular Formula: C8H9NaO3S
Molecular Weight: 208.21 g/mol
InChI Key: GJQXYSKWRDJNAJ-UHFFFAOYSA-M
InChI: InChI=1S/C8H10O3S.Na/c1-6-3-4-8(7(2)5-6)12(9,10)11;/h3-5H,1-2H3,(H,9,10,11);/q;+1/p-1

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

Melting_Point:	112-116 °C(lit.)
FW:	208.21000
CAS:	827-21-4
MF:	C8H9NaO3S
Flash_Point:	N/A
Product_Name:	Sodium 2,4-dimethylbenzenesulfonate
Bolling_Point:	N/A
Density:	N/A

Melting_Point:	112-116 °C(lit.)
MF:	C8H9NaO3S
Exact_Mass:	208.01700
LogP:	2.28830
FW:	208.21000
PSA:	65.58000
More_Info:	['1 . Appearance Unknow ', '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']
Computational_Chemistry:	['1 . Hydrogen Bond Donor Count 0 ', '2 . Hydrogen Bond Acceptor Count 3 ', '3 . Rotatable Bond Count 1 ', '4 . TPSA 572 ', '5 . Heavy Atom Count 13 ', '6 . Topological Polar Surface Area 0 ', '7 . Complexity 245 ', '8 . Isotope Atom Count 0 ', '9 . Defined Atom Stereocenter Count 0 ', '10 . Undefined Atom Stereocenter Count 0 ', '11 . Defined Bond Stereocenter Count 0 ', '12 . Undefined Bond Stereocenter Count 0 ', '13 . Covalently-Bonded Unit Count 2']