4-propoxypent-1-enyl hypofluorite

C8H15FO2 — CID 140539311

IUPAC4-propoxypent-1-enyl hypofluorite
SMILESCCCOC(C)CC=COF
InChIInChI=1S/C8H15FO2/c1-3-6-10-8(2)5-4-7-11-9/h4,7-8H,3,5-6H2,1-2H3
InChIKeyOADAUSIWVYYLON-UHFFFAOYSA-N
MW162.20 g/mol
LogP2.61
Rot. Bonds6

About 4-propoxypent-1-enyl hypofluorite

4-propoxypent-1-enyl hypofluorite (PubChem CID 140539311) has the molecular formula C8H15FO2 and a molecular weight of 162.20 g/mol. Its IUPAC name is 4-propoxypent-1-enyl hypofluorite.

Molecular Properties

Compound Name4-propoxypent-1-enyl hypofluorite
PubChem CID140539311
Molecular FormulaC8H15FO2
Molecular Weight162.20 g/mol
Exact Mass162.11
IUPAC Name4-propoxypent-1-enyl hypofluorite
SMILESCCCOC(C)CC=COF
InChIInChI=1S/C8H15FO2/c1-3-6-10-8(2)5-4-7-11-9/h4,7-8H,3,5-6H2,1-2H3
InChIKeyOADAUSIWVYYLON-UHFFFAOYSA-N
XLogP2.61
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-propoxypent-1-enyl hypofluorite?
The IUPAC name of 4-propoxypent-1-enyl hypofluorite (CID 140539311) is 4-propoxypent-1-enyl hypofluorite.
What is the SMILES notation for 4-propoxypent-1-enyl hypofluorite?
The canonical SMILES for 4-propoxypent-1-enyl hypofluorite is CCCOC(C)CC=COF.
What is the InChIKey of 4-propoxypent-1-enyl hypofluorite?
The InChIKey is OADAUSIWVYYLON-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15FO2/c1-3-6-10-8(2)5-4-7-11-9/h4,7-8H,3,5-6H2,1-2H3.
What are the key properties of 4-propoxypent-1-enyl hypofluorite?
4-propoxypent-1-enyl hypofluorite has a molecular weight of 162.20 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 4-propoxypent-1-enyl hypofluorite is sourced from PubChem (CID 140539311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).