fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane

C10H23FO3S — CID 129214776

IUPACfluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane
SMILESCOCCOCCOCCCS(C)(C)F
InChIInChI=1S/C10H23FO3S/c1-12-6-7-14-9-8-13-5-4-10-15(2,3)11/h4-10H2,1-3H3
InChIKeyWWFWWHRBYHVXRS-UHFFFAOYSA-N
MW242.36 g/mol
LogP2.00
Rot. Bonds10

About fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane

fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane (PubChem CID 129214776) has the molecular formula C10H23FO3S and a molecular weight of 242.36 g/mol. Its IUPAC name is fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane.

Molecular Properties

Compound Namefluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane
PubChem CID129214776
Molecular FormulaC10H23FO3S
Molecular Weight242.36 g/mol
Exact Mass242.14
IUPAC Namefluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane
SMILESCOCCOCCOCCCS(C)(C)F
InChIInChI=1S/C10H23FO3S/c1-12-6-7-14-9-8-13-5-4-10-15(2,3)11/h4-10H2,1-3H3
InChIKeyWWFWWHRBYHVXRS-UHFFFAOYSA-N
XLogP2.00
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane?
The IUPAC name of fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane (CID 129214776) is fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane.
What is the SMILES notation for fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane?
The canonical SMILES for fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane is COCCOCCOCCCS(C)(C)F.
What is the InChIKey of fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane?
The InChIKey is WWFWWHRBYHVXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23FO3S/c1-12-6-7-14-9-8-13-5-4-10-15(2,3)11/h4-10H2,1-3H3.
What are the key properties of fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane?
fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane has a molecular weight of 242.36 g/mol, XLogP of 2.00, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-dimethyl-λ4-sulfane is sourced from PubChem (CID 129214776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).