Molecular Formula: 416.3
Formula Weight: C17H10N2Na2O6S
Inchl Key: UUDYLQGRFBLCTF-UHFFFAOYSA-L
Inchl: InChI=1S/C17H12N2O6S.2Na/c20-16-6-4-13(9-15(16)17(21)22)19-18-12-3-1-11-8-14(26(23,24)25)5-2-10(11)7-12;;/h1-9,20H,(H,21,22)(H,23,24,25);;/q;2*+1/p-2

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:	Mordant Yellow 3
Flash_Point:	N/A
Melting_Point:	N/A
FW:	416.31600
Density:	N/A
CAS:	6054-97-3
Bolling_Point:	N/A
MF:	C17H10N2Na2O6S

Computational_Chemistry:	['1 . XlogP ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 8 ', '4 . Rotatable Bond Count 2 ', '5 . Isotope Atom Count 4 ', '6 . TPSA 139 ', '7 . Heavy Atom Count 28 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 774 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 0 ', '12 . Undefined Atom Stereocenter Count 0 ', '13 . Defined Bond Stereocenter Count 1 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 3']
LogP:	3.30920
FW:	416.31600
More_Info:	['1 . Appearance 不确定。 ', '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 Soluble in Water ,微Soluble in Ethanol and 丙酮Insoluble in 苯']
PSA:	150.66000
MF:	C17H10N2Na2O6S
Exact_Mass:	416.00500