Home Other Building Blocks perfluorohexane-1-sulphonic acid

perfluorohexane-1-sulphonic acid

CAS No.:
355-46-4
Catalog Number:
AG00C6JL
Molecular Formula:
C6HF13O3S
Molecular Weight:
400.1146
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Purity
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Product Description
Catalog Number:
AG00C6JL
Chemical Name:
perfluorohexane-1-sulphonic acid
CAS Number:
355-46-4
Molecular Formula:
C6HF13O3S
Molecular Weight:
400.1146
MDL Number:
MFCD00042453
IUPAC Name:
1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonic acid
InChI:
InChI=1S/C6HF13O3S/c7-1(8,3(11,12)5(15,16)17)2(9,10)4(13,14)6(18,19)23(20,21)22/h(H,20,21,22)
InChI Key:
QZHDEAJFRJCDMF-UHFFFAOYSA-N
SMILES:
FC(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
EC Number:
206-587-1
UNII:
ZU6Y1E592S
Properties
Complexity:
553  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.944g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
16  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
400.11g/mol
Monoisotopic Mass:
399.944g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
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Perfluorooctanesulfonate and related fluorinated hydrocarbons in mink and river otters from the United States. Environmental science & technology 20020615
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