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Perfluorobutanesulfonic Acid

CAT: 1299-RG-A260721-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-A260721-01Size:10 mg
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CAS Number
375-73-5
Synonyms
Perfluorobutanesulfonic Acid
Molecular Formula
C4HF9O3S
Molecular Weight
300.1
Target Alternative Name
Perfluoroalkyl Sulfonates
Product Name Synonym
Perfluorobutanesulfonic Acid

Chemical Information

Perfluorobutanesulfonic acid

Perfluorobutanesulfonic acid is a perfluoroalkanesulfonic acid that is butane-1-sulfonic acid in which all of the hydrogens of the butyl group have been replaced by fluorines. It has a role as a surfactant.

CAS Number375-73-5
PubChem CID67815
IUPAC Name1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonic acid
Molecular FormulaC4HF9O3S
Molecular Weight300.10
XLogP2.3
Topological Polar Surface Area62.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count12
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity387
SMILES
C(C(C(F)(F)S(=O)(=O)O)(F)F)(C(F)(F)F)(F)F
InChI
InChI=1S/C4HF9O3S/c5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h(H,14,15,16)
InChIKey
JGTNAGYHADQMCM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Perfluorobutanesulfonic acid
CAS: 375-73-5
CID: 67815
Formula: C4HF9O3S
MW: 300.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight300.10
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count12
Rotatable Bond Count3
Exact Mass299.95026852
Monoisotopic Mass299.95026852
Topological Polar Surface Area62.8 Ų
Heavy Atom Count17
Formal Charge0
Complexity387
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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