Molecular Formula: 498.5
Formula Weight: C17H12N2Na2O7S3
Inchl Key: NPAWAMRXPHRVQY-WTVBWJGASA-L
Inchl: InChI=1S/C17H14N2O7S3.2Na/c1-11(20)19-15-7-5-13(17(9-15)29(24,25)26)3-2-12-4-6-14(18-10-27)8-16(12)28(21,22)23;;/h2-9H,1H3,(H,19,20)(H,21,22,23)(H,24,25,26);;/q;2*+1/p-2/b3-2+;;

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

Symbol:	Danger
FW:	498.461
Density:	1.52g/cm3
CAS:	51023-76-8
Bolling_Point:	N/A
Product_Name:	4-Acetamido-4'-isothiocyanatostilbene-2,2'-disulfonic Acid, Sodium Salt
Melting_Point:	>300ºC (dec.)
Flash_Point:	N/A
MF:	C17H12N2Na2O7S3

LogP:	4.59250
FW:	498.461
Density:	1.52g/cm3
Computational_Chemistry:	['1 . XlogP 未确定 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 8 ', '4 . Rotatable Bond Count 4 ', '5 . Isotope Atom Count 2 ', '6 . TPSA 156 ', '7 . Heavy Atom Count 31 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 856 ', '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']
Melting_Point:	>300ºC (dec.)
PSA:	204.71000
Exact_Mass:	497.960205
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL,25ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1） Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC）Unknow ', '6 . Boiling point（ºC，15mm hg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（°F）Unknow ', '9 . Specific rotation（ºC）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC） Unknow ', '11 . Vapor pressure（kPa,20ºC）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']
MF:	C17H12N2Na2O7S3

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Faceshields;Gloves
Hazard_Codes:	Xn
Risk_Statements(EU):	R22
Safety_Statements:	S22-S26-S36/37
Symbol:	Danger
RIDADR:	NONH for all modes of transport
Warning_Statement:	P261-P284-P301 + P312 + P330-P304 + P340-P305 + P351 + P338-P342 + P311
WGK_Germany:	3