1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane

C6H10F4OS — CID 139683206

IUPAC1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane
SMILESCCSCCOC(F)(F)C(F)F
InChIInChI=1S/C6H10F4OS/c1-2-12-4-3-11-6(9,10)5(7)8/h5H,2-4H2,1H3
InChIKeyYZORHJAPJVKWEZ-UHFFFAOYSA-N
MW206.20 g/mol
LogP2.61
Rot. Bonds6

About 1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane

1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane (PubChem CID 139683206) has the molecular formula C6H10F4OS and a molecular weight of 206.20 g/mol. Its IUPAC name is 1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane.

Molecular Properties

Compound Name1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane
PubChem CID139683206
Molecular FormulaC6H10F4OS
Molecular Weight206.20 g/mol
Exact Mass206.04
IUPAC Name1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane
SMILESCCSCCOC(F)(F)C(F)F
InChIInChI=1S/C6H10F4OS/c1-2-12-4-3-11-6(9,10)5(7)8/h5H,2-4H2,1H3
InChIKeyYZORHJAPJVKWEZ-UHFFFAOYSA-N
XLogP2.61
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(1,1,2,2-tetrafluoroethoxymethyl)pentane
CID 139669688
1-ethylsulfanyl-2-[2-[2-(2-ethylsulfanylethylsulfanyl)ethylsulfanyl]ethylsulfanyl]ethane
CID 121008102
1,3-bis(1,1,2,2-tetrafluoroethoxy)-2,2-bis(1,1,2,2-tetrafluoroethoxymethyl)propane
CID 15155951
N-(2-ethylsulfanylethyl)-2,2,3,3-tetrafluoropropan-1-amine
CID 103529596
N-(3-ethylsulfanylpropyl)-2,2,3,3-tetrafluoropropan-1-amine
CID 103529290
1,1,2,4,4,4-hexafluoro-1-propoxybutane
CID 175770445
1-methoxy-2,2-bis(1,1,2,2-tetrafluoroethoxymethyl)pentane;1-methoxy-3-(1,1,2,2-tetrafluoroethoxy)-2,2-bis(1,1,2,2-tetrafluoroethoxymethyl)propane
CID 90942370
2-ethylsulfanylethyl cyanate
CID 23331214
2-ethylsulfanylethyl ethanesulfonate
CID 139906268
chloro-dimethyl-[1-(1,1,2,2-tetrafluoroethoxy)propyl]silane
CID 88684719
1-ethoxy-2-[2-[2-[2-(2-ethoxyethylsulfanyl)ethylsulfanyl]ethylsulfanyl]ethylsulfanyl]ethane
CID 5171446
tris[2-(2-ethylsulfanylethoxy)ethyl] borate
CID 11812524

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane?
The IUPAC name of 1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane (CID 139683206) is 1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane.
What is the SMILES notation for 1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane?
The canonical SMILES for 1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane is CCSCCOC(F)(F)C(F)F.
What is the InChIKey of 1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane?
The InChIKey is YZORHJAPJVKWEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F4OS/c1-2-12-4-3-11-6(9,10)5(7)8/h5H,2-4H2,1H3.
What are the key properties of 1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane?
1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane has a molecular weight of 206.20 g/mol, XLogP of 2.61, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylsulfanylethoxy)-1,1,2,2-tetrafluoroethane is sourced from PubChem (CID 139683206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).