Chemical Name: ALIZARIN RUBINOL R
Molecular Formula: C24H17N2NaO5S
Molecular Weight: 468.5
InChI Key: RNTNZRPCYDDMIA-UHFFFAOYSA-M
InChI: InChI=1S/C24H18N2O5S.Na/c1-13-7-8-17(20(11-13)32(29,30)31)25-18-9-10-19-22-16(12-21(27)26(19)2)14-5-3-4-6-15(14)24(28)23(18)22;/h3-12,25H,1-2H3,(H,29,30,31);/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

Product_Name:	Alizarin Rubinol R
Flash_Point:	N/A
Melting_Point:	N/A
FW:	468.457
Density:	N/A
CAS:	4478-76-6
Bolling_Point:	N/A
MF:	C24H17N2NaO5S

Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :4 ', '6. TPSA 115 ', '7. Heavy Atom Count :33 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :932 ', '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 :2']
LogP:	4.75280
Refractive_Index:	1.764
FW:	468.457
More_Info:	['1 . Appearance 不确定 ', '2 . Density（g/ml, 20°C ）不确定 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）不确定 ', '5 . Boiling point（ºC,Atmospheric pressure）不确定 ', '6 . Boiling point（ºC,50mmHg）不确定 ', '7 . Refractive index不确定 ', '8 . Flash point（ºF）不确定 ', '9 . Specific rotation（º）不确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,20ºC）不确定 ', '12 . Saturated vapor pressure（kPa,60ºC）不确定 ', '13 . Combustion heat（KJ/mol）不确定 ', '14 . Critical temperature（ºC）不确定 ', '15 . Critical pressure（KPa）不确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion（%,V/V）不确定 ', '18 . Lower limit of explosion（%,V/V）不确定 ', '19 . Solubility 不确定']
PSA:	116.68000
MF:	C24H17N2NaO5S
Exact_Mass:	468.075592

Hazard_Codes:	Xi
RIDADR:	UN 1993 3/PG 3
Risk_Statements(EU):	R36/37/38:Irritating to eyes, respiratory system and skin .
WGK_Germany:	3
Safety_Statements:	S26-S36/37