2-(fluoromethyl)oxolane

C5H9FO — CID 54073626

IUPAC2-(fluoromethyl)oxolane
SMILESFCC1CCCO1
InChIInChI=1S/C5H9FO/c6-4-5-2-1-3-7-5/h5H,1-4H2
InChIKeyVQWOHDSQFUHPFS-UHFFFAOYSA-N
MW104.12 g/mol
LogP1.13
Rot. Bonds1

About 2-(fluoromethyl)oxolane

2-(fluoromethyl)oxolane (PubChem CID 54073626) has the molecular formula C5H9FO and a molecular weight of 104.12 g/mol. Its IUPAC name is 2-(fluoromethyl)oxolane.

Molecular Properties

Compound Name2-(fluoromethyl)oxolane
PubChem CID54073626
Molecular FormulaC5H9FO
Molecular Weight104.12 g/mol
Exact Mass104.06
IUPAC Name2-(fluoromethyl)oxolane
SMILESFCC1CCCO1
InChIInChI=1S/C5H9FO/c6-4-5-2-1-3-7-5/h5H,1-4H2
InChIKeyVQWOHDSQFUHPFS-UHFFFAOYSA-N
XLogP1.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.12
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)oxolane?
The IUPAC name of 2-(fluoromethyl)oxolane (CID 54073626) is 2-(fluoromethyl)oxolane.
What is the SMILES notation for 2-(fluoromethyl)oxolane?
The canonical SMILES for 2-(fluoromethyl)oxolane is FCC1CCCO1.
What is the InChIKey of 2-(fluoromethyl)oxolane?
The InChIKey is VQWOHDSQFUHPFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9FO/c6-4-5-2-1-3-7-5/h5H,1-4H2.
What are the key properties of 2-(fluoromethyl)oxolane?
2-(fluoromethyl)oxolane has a molecular weight of 104.12 g/mol, XLogP of 1.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)oxolane is sourced from PubChem (CID 54073626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).