1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide

C3F8O2S — CID 175557658

IUPAC1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide
SMILESFC(F)(F)C(F)(F)C(F)(F)F.O=S=O
InChIInChI=1S/C3F8.O2S/c4-1(5,2(6,7)8)3(9,10)11;1-3-2
InChIKeyDLDVNJHHRHAQAE-UHFFFAOYSA-N
MW252.08 g/mol
LogP2.08
Rot. Bonds

About 1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide

1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide (PubChem CID 175557658) has the molecular formula C3F8O2S and a molecular weight of 252.08 g/mol. Its IUPAC name is 1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide.

Molecular Properties

Compound Name1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide
PubChem CID175557658
Molecular FormulaC3F8O2S
Molecular Weight252.08 g/mol
Exact Mass251.95
IUPAC Name1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide
SMILESFC(F)(F)C(F)(F)C(F)(F)F.O=S=O
InChIInChI=1S/C3F8.O2S/c4-1(5,2(6,7)8)3(9,10)11;1-3-2
InChIKeyDLDVNJHHRHAQAE-UHFFFAOYSA-N
XLogP2.08
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.08
LogP ≤ 52.08
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;sulfur dioxide?
The IUPAC name of 1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide (CID 175557658) is 1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide.
What is the SMILES notation for 1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide?
The canonical SMILES for 1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide is FC(F)(F)C(F)(F)C(F)(F)F.O=S=O.
What is the InChIKey of 1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide?
The InChIKey is DLDVNJHHRHAQAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3F8.O2S/c4-1(5,2(6,7)8)3(9,10)11;1-3-2.
What are the key properties of 1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide?
1,1,1,2,2,3,3,3-octafluoropropane;sulfur dioxide has a molecular weight of 252.08 g/mol, XLogP of 2.08, 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;sulfur dioxide is sourced from PubChem (CID 175557658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).