1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride

C3F10O2S — CID 87247763

IUPAC1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride
SMILESFC(F)(F)C(F)(F)C(F)(F)F.O=S(=O)(F)F
InChIInChI=1S/C3F8.F2O2S/c4-1(5,2(6,7)8)3(9,10)11;1-5(2,3)4
InChIKeyZRASGBJQTZYAPH-UHFFFAOYSA-N
MW290.08 g/mol
LogP2.92
Rot. Bonds

About 1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride

1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride (PubChem CID 87247763) has the molecular formula C3F10O2S and a molecular weight of 290.08 g/mol. Its IUPAC name is 1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride.

Molecular Properties

Compound Name1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride
PubChem CID87247763
Molecular FormulaC3F10O2S
Molecular Weight290.08 g/mol
Exact Mass289.95
IUPAC Name1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride
SMILESFC(F)(F)C(F)(F)C(F)(F)F.O=S(=O)(F)F
InChIInChI=1S/C3F8.F2O2S/c4-1(5,2(6,7)8)3(9,10)11;1-5(2,3)4
InChIKeyZRASGBJQTZYAPH-UHFFFAOYSA-N
XLogP2.92
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.08
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride?
The IUPAC name of 1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride (CID 87247763) is 1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride.
What is the SMILES notation for 1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride?
The canonical SMILES for 1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride is FC(F)(F)C(F)(F)C(F)(F)F.O=S(=O)(F)F.
What is the InChIKey of 1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride?
The InChIKey is ZRASGBJQTZYAPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3F8.F2O2S/c4-1(5,2(6,7)8)3(9,10)11;1-5(2,3)4.
What are the key properties of 1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride?
1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride has a molecular weight of 290.08 g/mol, XLogP of 2.92, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,2,3,3,3-octafluoropropane;sulfuryl difluoride is sourced from PubChem (CID 87247763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).