potassium 1,1,2,2,3,3,4,4-octafluoropentane

C5H3F8K — CID 155749437

IUPACpotassium 1,1,2,2,3,3,4,4-octafluoropentane
SMILESCC(F)(F)C(F)(F)C(F)(F)[C-](F)F.[K+]
InChIInChI=1S/C5H3F8.K/c1-3(8,9)5(12,13)4(10,11)2(6)7;/h1H3;/q-1;+1
InChIKeyYPXMHNVSFWRVEE-UHFFFAOYSA-N
MW254.16 g/mol
LogP0.34
Rot. Bonds3

About potassium 1,1,2,2,3,3,4,4-octafluoropentane

potassium 1,1,2,2,3,3,4,4-octafluoropentane (PubChem CID 155749437) has the molecular formula C5H3F8K and a molecular weight of 254.16 g/mol. Its IUPAC name is potassium 1,1,2,2,3,3,4,4-octafluoropentane.

Molecular Properties

Compound Namepotassium 1,1,2,2,3,3,4,4-octafluoropentane
PubChem CID155749437
Molecular FormulaC5H3F8K
Molecular Weight254.16 g/mol
Exact Mass253.97
IUPAC Namepotassium 1,1,2,2,3,3,4,4-octafluoropentane
SMILESCC(F)(F)C(F)(F)C(F)(F)[C-](F)F.[K+]
InChIInChI=1S/C5H3F8.K/c1-3(8,9)5(12,13)4(10,11)2(6)7;/h1H3;/q-1;+1
InChIKeyYPXMHNVSFWRVEE-UHFFFAOYSA-N
XLogP0.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.16
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

cobalt;1,1,1,2,2,3,3,4,4-nonafluorobutane
CID 172825555
2,2,3,3,4,4-hexafluoropentane
CID 18188371
ethane;2,2,3,3,4,4,5,5-octafluorohexane
CID 144773774
sodium 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16-tritriacontafluorohexadecane
CID 175872951
ethane;1,1,1,2,2,3,3-heptafluorobutane
CID 170760942
1,2,2,3,3-pentafluorobutane-1,1-diol
CID 150527762
1,1,1,2,2,3,3,4,4-nonafluoro-5,5-dimethylhexane
CID 129191399
2,2,3,3,4-pentafluoro-4-iodopentane
CID 139341461
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-nonadecafluorodecane
CID 22600357
1,1,1,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-2-(trifluoromethyl)nonane
CID 167303486
1,1,1-trifluoroethane
CID 91327996
1,1,1-trifluoroethane
CID 9868

Frequently Asked Questions

What is the IUPAC name of potassium 1,1,2,2,3,3,4,4-octafluoropentane?
The IUPAC name of potassium 1,1,2,2,3,3,4,4-octafluoropentane (CID 155749437) is potassium 1,1,2,2,3,3,4,4-octafluoropentane.
What is the SMILES notation for potassium 1,1,2,2,3,3,4,4-octafluoropentane?
The canonical SMILES for potassium 1,1,2,2,3,3,4,4-octafluoropentane is CC(F)(F)C(F)(F)C(F)(F)[C-](F)F.[K+].
What is the InChIKey of potassium 1,1,2,2,3,3,4,4-octafluoropentane?
The InChIKey is YPXMHNVSFWRVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3F8.K/c1-3(8,9)5(12,13)4(10,11)2(6)7;/h1H3;/q-1;+1.
What are the key properties of potassium 1,1,2,2,3,3,4,4-octafluoropentane?
potassium 1,1,2,2,3,3,4,4-octafluoropentane has a molecular weight of 254.16 g/mol, XLogP of 0.34, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 1,1,2,2,3,3,4,4-octafluoropentane is sourced from PubChem (CID 155749437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).