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disodium;3-(3-sulfonatophenyl)sulfonylbenzenesulfonate

Catalog No: FT-0707775

CAS No: 39616-93-8

Chemical Name: disodium;3-(3-sulfonatophenyl)sulfonylbenzenesulfonate
Molecular Formula: C12H8Na2O8S3
Molecular Weight: 422.4
InChI Key: GOPLREGDBGPRSC-UHFFFAOYSA-L
InChI: InChI=1S/C12H10O8S3.2Na/c13-21(14,9-3-1-5-11(7-9)22(15,16)17)10-4-2-6-12(8-10)23(18,19)20;;/h1-8H,(H,15,16,17)(H,18,19,20);;/q;2*+1/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

Melting_Point:	N/A
FW:	422.362
CAS:	39616-93-8
MF:	C12H8Na2O8S3
Flash_Point:	N/A
Product_Name:	Disodium 3,3'-sulfonyldibenzenesulfonate
Bolling_Point:	N/A
Density:	1.694g/cm3

Refractive_Index:	1.645
MF:	C12H8Na2O8S3
Exact_Mass:	421.917664
LogP:	3.57000
FW:	422.362
Density:	1.694g/cm3
PSA:	173.68000
Computational_Chemistry:	['1 . XlogP -01 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 8 ', '4 . Rotatable Bond Count 4 ', '5 . TPSA 143 ', '6 . Heavy Atom Count 23 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 663 ', '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']