morpholin-4-yl thiohypofluorite

C4H8FNOS — CID 139893676

IUPACmorpholin-4-yl thiohypofluorite
SMILESFSN1CCOCC1
InChIInChI=1S/C4H8FNOS/c5-8-6-1-3-7-4-2-6/h1-4H2
InChIKeyPESXHLKMBWHDIZ-UHFFFAOYSA-N
MW137.18 g/mol
LogP0.85
Rot. Bonds1

About morpholin-4-yl thiohypofluorite

morpholin-4-yl thiohypofluorite (PubChem CID 139893676) has the molecular formula C4H8FNOS and a molecular weight of 137.18 g/mol. Its IUPAC name is morpholin-4-yl thiohypofluorite.

Molecular Properties

Compound Namemorpholin-4-yl thiohypofluorite
PubChem CID139893676
Molecular FormulaC4H8FNOS
Molecular Weight137.18 g/mol
Exact Mass137.03
IUPAC Namemorpholin-4-yl thiohypofluorite
SMILESFSN1CCOCC1
InChIInChI=1S/C4H8FNOS/c5-8-6-1-3-7-4-2-6/h1-4H2
InChIKeyPESXHLKMBWHDIZ-UHFFFAOYSA-N
XLogP0.85
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 50.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl thiohypofluorite?
The IUPAC name of morpholin-4-yl thiohypofluorite (CID 139893676) is morpholin-4-yl thiohypofluorite.
What is the SMILES notation for morpholin-4-yl thiohypofluorite?
The canonical SMILES for morpholin-4-yl thiohypofluorite is FSN1CCOCC1.
What is the InChIKey of morpholin-4-yl thiohypofluorite?
The InChIKey is PESXHLKMBWHDIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8FNOS/c5-8-6-1-3-7-4-2-6/h1-4H2.
What are the key properties of morpholin-4-yl thiohypofluorite?
morpholin-4-yl thiohypofluorite has a molecular weight of 137.18 g/mol, XLogP of 0.85, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl thiohypofluorite is sourced from PubChem (CID 139893676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).