[4-(2-methoxyethyl)phenyl] thiohypofluorite

C9H11FOS — CID 139540069

IUPAC[4-(2-methoxyethyl)phenyl] thiohypofluorite
SMILESCOCCc1ccc(SF)cc1
InChIInChI=1S/C9H11FOS/c1-11-7-6-8-2-4-9(12-10)5-3-8/h2-5H,6-7H2,1H3
InChIKeyDFPMQHLPKUBMLT-UHFFFAOYSA-N
MW186.25 g/mol
LogP2.85
Rot. Bonds4

About [4-(2-methoxyethyl)phenyl] thiohypofluorite

[4-(2-methoxyethyl)phenyl] thiohypofluorite (PubChem CID 139540069) has the molecular formula C9H11FOS and a molecular weight of 186.25 g/mol. Its IUPAC name is [4-(2-methoxyethyl)phenyl] thiohypofluorite.

Molecular Properties

Compound Name[4-(2-methoxyethyl)phenyl] thiohypofluorite
PubChem CID139540069
Molecular FormulaC9H11FOS
Molecular Weight186.25 g/mol
Exact Mass186.05
IUPAC Name[4-(2-methoxyethyl)phenyl] thiohypofluorite
SMILESCOCCc1ccc(SF)cc1
InChIInChI=1S/C9H11FOS/c1-11-7-6-8-2-4-9(12-10)5-3-8/h2-5H,6-7H2,1H3
InChIKeyDFPMQHLPKUBMLT-UHFFFAOYSA-N
XLogP2.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(2-methoxyethyl)phenyl] thiohypofluorite?
The IUPAC name of [4-(2-methoxyethyl)phenyl] thiohypofluorite (CID 139540069) is [4-(2-methoxyethyl)phenyl] thiohypofluorite.
What is the SMILES notation for [4-(2-methoxyethyl)phenyl] thiohypofluorite?
The canonical SMILES for [4-(2-methoxyethyl)phenyl] thiohypofluorite is COCCc1ccc(SF)cc1.
What is the InChIKey of [4-(2-methoxyethyl)phenyl] thiohypofluorite?
The InChIKey is DFPMQHLPKUBMLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FOS/c1-11-7-6-8-2-4-9(12-10)5-3-8/h2-5H,6-7H2,1H3.
What are the key properties of [4-(2-methoxyethyl)phenyl] thiohypofluorite?
[4-(2-methoxyethyl)phenyl] thiohypofluorite has a molecular weight of 186.25 g/mol, XLogP of 2.85, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methoxyethyl)phenyl] thiohypofluorite is sourced from PubChem (CID 139540069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).