2,3,4,4-tetrafluorothiolane 1,1-dioxide

C4H4F4O2S — CID 87128652

IUPAC2,3,4,4-tetrafluorothiolane 1,1-dioxide
SMILESO=S1(=O)CC(F)(F)C(F)C1F
InChIInChI=1S/C4H4F4O2S/c5-2-3(6)11(9,10)1-4(2,7)8/h2-3H,1H2
InChIKeyCTCKTAOIECRXNM-UHFFFAOYSA-N
MW192.13 g/mol
LogP0.68
Rot. Bonds

About 2,3,4,4-tetrafluorothiolane 1,1-dioxide

2,3,4,4-tetrafluorothiolane 1,1-dioxide (PubChem CID 87128652) has the molecular formula C4H4F4O2S and a molecular weight of 192.13 g/mol. Its IUPAC name is 2,3,4,4-tetrafluorothiolane 1,1-dioxide.

Molecular Properties

Compound Name2,3,4,4-tetrafluorothiolane 1,1-dioxide
PubChem CID87128652
Molecular FormulaC4H4F4O2S
Molecular Weight192.13 g/mol
Exact Mass191.99
IUPAC Name2,3,4,4-tetrafluorothiolane 1,1-dioxide
SMILESO=S1(=O)CC(F)(F)C(F)C1F
InChIInChI=1S/C4H4F4O2S/c5-2-3(6)11(9,10)1-4(2,7)8/h2-3H,1H2
InChIKeyCTCKTAOIECRXNM-UHFFFAOYSA-N
XLogP0.68
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.13
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,4-tetrafluorothiolane 1,1-dioxide?
The IUPAC name of 2,3,4,4-tetrafluorothiolane 1,1-dioxide (CID 87128652) is 2,3,4,4-tetrafluorothiolane 1,1-dioxide.
What is the SMILES notation for 2,3,4,4-tetrafluorothiolane 1,1-dioxide?
The canonical SMILES for 2,3,4,4-tetrafluorothiolane 1,1-dioxide is O=S1(=O)CC(F)(F)C(F)C1F.
What is the InChIKey of 2,3,4,4-tetrafluorothiolane 1,1-dioxide?
The InChIKey is CTCKTAOIECRXNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4F4O2S/c5-2-3(6)11(9,10)1-4(2,7)8/h2-3H,1H2.
What are the key properties of 2,3,4,4-tetrafluorothiolane 1,1-dioxide?
2,3,4,4-tetrafluorothiolane 1,1-dioxide has a molecular weight of 192.13 g/mol, XLogP of 0.68, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,4-tetrafluorothiolane 1,1-dioxide is sourced from PubChem (CID 87128652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).