5-(fluoromethyl)-4-methyloxolan-3-ol

C6H11FO2 — CID 58952835

IUPAC5-(fluoromethyl)-4-methyloxolan-3-ol
SMILESCC1C(O)COC1CF
InChIInChI=1S/C6H11FO2/c1-4-5(8)3-9-6(4)2-7/h4-6,8H,2-3H2,1H3
InChIKeyHFRNEGLMTVXURQ-UHFFFAOYSA-N
MW134.15 g/mol
LogP0.35
Rot. Bonds1

About 5-(fluoromethyl)-4-methyloxolan-3-ol

5-(fluoromethyl)-4-methyloxolan-3-ol (PubChem CID 58952835) has the molecular formula C6H11FO2 and a molecular weight of 134.15 g/mol. Its IUPAC name is 5-(fluoromethyl)-4-methyloxolan-3-ol.

Molecular Properties

Compound Name5-(fluoromethyl)-4-methyloxolan-3-ol
PubChem CID58952835
Molecular FormulaC6H11FO2
Molecular Weight134.15 g/mol
Exact Mass134.07
IUPAC Name5-(fluoromethyl)-4-methyloxolan-3-ol
SMILESCC1C(O)COC1CF
InChIInChI=1S/C6H11FO2/c1-4-5(8)3-9-6(4)2-7/h4-6,8H,2-3H2,1H3
InChIKeyHFRNEGLMTVXURQ-UHFFFAOYSA-N
XLogP0.35
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.15
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(fluoromethyl)-4-methyloxolan-3-ol?
The IUPAC name of 5-(fluoromethyl)-4-methyloxolan-3-ol (CID 58952835) is 5-(fluoromethyl)-4-methyloxolan-3-ol.
What is the SMILES notation for 5-(fluoromethyl)-4-methyloxolan-3-ol?
The canonical SMILES for 5-(fluoromethyl)-4-methyloxolan-3-ol is CC1C(O)COC1CF.
What is the InChIKey of 5-(fluoromethyl)-4-methyloxolan-3-ol?
The InChIKey is HFRNEGLMTVXURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11FO2/c1-4-5(8)3-9-6(4)2-7/h4-6,8H,2-3H2,1H3.
What are the key properties of 5-(fluoromethyl)-4-methyloxolan-3-ol?
5-(fluoromethyl)-4-methyloxolan-3-ol has a molecular weight of 134.15 g/mol, XLogP of 0.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(fluoromethyl)-4-methyloxolan-3-ol is sourced from PubChem (CID 58952835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).