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113589-72-3

113589-72-3 | Benzene, 1,1'-[1,2-ethynediylbis(thio)]bis[2,3,4,5,6-pentafluoro-

CAS No: 113589-72-3 Catalog No: AG00092S MDL No:

Product Description

Catalog Number:
AG00092S
Chemical Name:
Benzene, 1,1'-[1,2-ethynediylbis(thio)]bis[2,3,4,5,6-pentafluoro-
CAS Number:
113589-72-3
Molecular Formula:
C14F10S2
Molecular Weight:
422.2638
IUPAC Name:
1,2,3,4,5-pentafluoro-6-[2-(2,3,4,5,6-pentafluorophenyl)sulfanylethynylsulfanyl]benzene
InChI:
InChI=1S/C14F10S2/c15-3-5(17)9(21)13(10(22)6(3)18)25-1-2-26-14-11(23)7(19)4(16)8(20)12(14)24
InChI Key:
UVADYYQXUNSJLT-UHFFFAOYSA-N
SMILES:
Fc1c(SC#CSc2c(F)c(F)c(c(c2F)F)F)c(F)c(c(c1F)F)F

Properties

Complexity:
476  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
421.928g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
422.258g/mol
Monoisotopic Mass:
421.928g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2  

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