AG003QI7

2225-23-2 | Ethylene di(thiotosylate)

AG003QI7

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CAS Number	2225-23-2
Catalog Number	AG003QI7(AGN-PC-0QYVDY)
Chemical Name	Ethylene di(thiotosylate)
EC Number	218-752-5
IUPAC Name	1-methyl-4-[2-(4-methylphenyl)sulfonylsulfanylethylsulfanylsulfonyl]benzene
InChI	InChI=1S/C16H18O4S4/c1-13-3-7-15(8-4-13)23(17,18)21-11-12-22-24(19,20)16-9-5-14(2)6-10-16/h3-10H,11-12H2,1-2H3
InChI Key	DUFUGAKEFZRFEQ-UHFFFAOYSA-N
MDL Number	MFCD00008550
Molecular Formula	C16H18O4S4
Molecular Weight	402.5717
SMILES	Cc1ccc(cc1)S(=O)(=O)SCCSS(=O)(=O)c2ccc(C)cc2
Synonyms	2225-23-2, s,s'-ethane-1,2-diyl bis(4-methylbenzenesulfonothioate), Ethylene S,S'-4-toluenethiosulphonate, 1,2-Di(p-tosylthio)ethane, 1,2-Ethanedithiol Ditosylate, 1-methyl-4-[2-(4-methylphenyl)sulfonylsulfanylethylsulfanylsulfonyl]benzene, Ethylene Di(thiotosylate) [Protecting Reagent for Active Methylene], Ethylenedithiotosylate, Ethylenebis(tosyl sulfide), AC1L2OA3, AC1Q6YF7, SCHEMBL6649884, CTK1A6824, DTXSID60176790, DUFUGAKEFZRFEQ-UHFFFAOYSA-N, ZINC1841356, EINECS 218-752-5, Ethylene Bis(p-toluenethiosulfonate), ANW-41936, MFCD00008550, S,S'-Ethylene p-Toluenethiosulfonate, S,S'-Ethylene-p-toluenethiosulfonate, AKOS015889076, ACM2225232, MCULE-9984452412, CJ-30007, E0471, FT-0634145, ST51038079, C-21761, J-014609, I01-17278, Benzenesulfonothioic acid, 4-methyl-, S,S'-1,2-ethanediyl ester, S,S inverted exclamation marka-Ethylene di(p-toluenethiosulfonate), [(4-methylphenyl)sulfonyl]{2-[(4-methylphenyl)sulfonylthio]ethyl}thio, S-(2-([(4-Methylphenyl)(dioxido)sulfanyl]sulfanyl)ethyl) 4-methylbenzenesulfonothioate #, Ethylene Di(thiotosylate), Ethylenedi(thiotosylate), CID75212, AR-1L3479, 22795-62-6,

Complexity	519
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	402.009g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	402.556g/mol
Monoisotopic Mass	402.009g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	136A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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