1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Pentacosafluorododecane-1-sulphonic acid

Base Information

• Chemical Name: 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Pentacosafluorododecane-1-sulphonic acid
• CAS No.: 79780-39-5
• Molecular Formula: C12H F25 O3 S
• Molecular Weight: 700.15962
• Hs Code.: 2904990090
• European Community (EC) Number: 279-259-9
• DSSTox Substance ID: DTXSID20873011
• Nikkaji Number: J320.157K
• Wikidata: Q81978594
• Mol file: 79780-39-5.mol

Synonyms:79780-39-5;perfluorododecanesulfonic acid;1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Pentacosafluorododecane-1-sulphonic acid;PFDoS;EINECS 279-259-9;1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-pentacosafluorododecane-1-sulfonic acid;Perfluordodecansulfonsaure;perfluorododecane sulfonic acid;SCHEMBL716738;C12HF25O3S;DTXSID20873011;C12-H-F25-O3-S;FT-0774649;1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Pentacosafluoro-1-dodecanesulfonic acid

Chemical Property of 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Pentacosafluorododecane-1-sulphonic acid

Chemical Property:

• PKA: -3.26±0.50(Predicted)
• PSA: 62.75000
• Density: 1.833g/cm³
• LogP: 8.46310
• XLogP3: 7.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 28
• Rotatable Bond Count: 11
• Exact Mass: 699.9247191
• Heavy Atom Count: 41
• Complexity: 1090

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: PFAS
• Canonical SMILES: C(C(C(C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F