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384342-61-4,MFCD01320453
Catalog No.:AA003IN5
384342-61-4 | 3,6,9,12,15-Pentaoxaheptadecane-1,17-diyl Bis-methanethiosulfonate
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Technical Information
Catalog Number:
AA003IN5
Chemical Name:
3,6,9,12,15-Pentaoxaheptadecane-1,17-diyl Bis-methanethiosulfonate
CAS Number:
384342-61-4
MDL Number:
MFCD01320453
IUPAC Name:
1-[2-(2-methylsulfonylsulfanylethoxy)ethoxy]-2-[2-[2-(2-methylsulfonylsulfanylethoxy)ethoxy]ethoxy]ethane
InChI:
InChI=1S/C14H30O9S4/c1-26(15,16)24-13-11-22-9-7-20-5-3-19-4-6-21-8-10-23-12-14-25-27(2,17)18/h3-14H2,1-2H3
InChI Key:
HWVTVNUGXMVSOL-UHFFFAOYSA-N
Properties
Computed Properties
 
Complexity:
478  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
470.077g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
11  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
470.625g/mol
Monoisotopic Mass:
470.077g/mol
Rotatable Bond Count:
20  
Topological Polar Surface Area:
182A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  

Synonyms
 
MTS-17-O5-MTS 
384342-61-4 
CID4182497 
CID 4182497 
3,6,9,12,15-PENTAOXAHEPTADECANE-1,17-DIYL BIS-METHANETHIOSULFONATE 
AC1N4PES 
SCHEMBL3490135 
CTK8E9072 
DTXSID00400405 
ZINC22065698 
RT-013964 
FT-0673601 
1-[2-(2-methylsulfonylsulfanylethoxy)ethoxy]-2-[2-[2-(2-methylsulfonylsulfanylethoxy)ethoxy]ethoxy]ethane 
Literature
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