6-fluoro-3-oxabicyclo[3.1.0]hexane

C5H7FO — CID 145484664

IUPAC6-fluoro-3-oxabicyclo[3.1.0]hexane
SMILESFC1C2COCC12
InChIInChI=1S/C5H7FO/c6-5-3-1-7-2-4(3)5/h3-5H,1-2H2
InChIKeyQIBMPNUAOYTQTR-UHFFFAOYSA-N
MW102.11 g/mol
LogP0.60
Rot. Bonds

About 6-fluoro-3-oxabicyclo[3.1.0]hexane

6-fluoro-3-oxabicyclo[3.1.0]hexane (PubChem CID 145484664) has the molecular formula C5H7FO and a molecular weight of 102.11 g/mol. Its IUPAC name is 6-fluoro-3-oxabicyclo[3.1.0]hexane.

Molecular Properties

Compound Name6-fluoro-3-oxabicyclo[3.1.0]hexane
PubChem CID145484664
Molecular FormulaC5H7FO
Molecular Weight102.11 g/mol
Exact Mass102.05
IUPAC Name6-fluoro-3-oxabicyclo[3.1.0]hexane
SMILESFC1C2COCC12
InChIInChI=1S/C5H7FO/c6-5-3-1-7-2-4(3)5/h3-5H,1-2H2
InChIKeyQIBMPNUAOYTQTR-UHFFFAOYSA-N
XLogP0.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.11
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-oxabicyclo[3.1.0]hexane?
The IUPAC name of 6-fluoro-3-oxabicyclo[3.1.0]hexane (CID 145484664) is 6-fluoro-3-oxabicyclo[3.1.0]hexane.
What is the SMILES notation for 6-fluoro-3-oxabicyclo[3.1.0]hexane?
The canonical SMILES for 6-fluoro-3-oxabicyclo[3.1.0]hexane is FC1C2COCC12.
What is the InChIKey of 6-fluoro-3-oxabicyclo[3.1.0]hexane?
The InChIKey is QIBMPNUAOYTQTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7FO/c6-5-3-1-7-2-4(3)5/h3-5H,1-2H2.
What are the key properties of 6-fluoro-3-oxabicyclo[3.1.0]hexane?
6-fluoro-3-oxabicyclo[3.1.0]hexane has a molecular weight of 102.11 g/mol, XLogP of 0.60, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-oxabicyclo[3.1.0]hexane is sourced from PubChem (CID 145484664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).