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144252-91-5 | Benzene, pentafluoro[[2-(pentafluorophenyl)ethyl]thio]- (9CI)
CAS No: 144252-91-5 Catalog No: AG001J6X MDL No:
Product Description
Catalog Number:
AG001J6X
Chemical Name:
Benzene, pentafluoro[[2-(pentafluorophenyl)ethyl]thio]- (9CI)
CAS Number:
144252-91-5
Molecular Formula:
C14H4F10S
Molecular Weight:
394.2306
IUPAC Name:
1,2,3,4,5-pentafluoro-6-[2-(2,3,4,5,6-pentafluorophenyl)ethylsulfanyl]benzene
InChI:
InChI=1S/C14H4F10S/c15-4-3(5(16)7(18)8(19)6(4)17)1-2-25-14-12(23)10(21)9(20)11(22)13(14)24/h1-2H2
InChI Key:
RCOULBSVKURHBI-UHFFFAOYSA-N
SMILES:
Fc1c(CCSc2c(F)c(F)c(c(c2F)F)F)c(F)c(c(c1F)F)F
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
393.987g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
394.23g/mol
Monoisotopic Mass:
393.987g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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