5-fluoro-5-(hydroxymethyl)oxolan-3-ol

C5H9FO3 — CID 150245788

IUPAC5-fluoro-5-(hydroxymethyl)oxolan-3-ol
SMILESOCC1(F)CC(O)CO1
InChIInChI=1S/C5H9FO3/c6-5(3-7)1-4(8)2-9-5/h4,7-8H,1-3H2
InChIKeyFYMFEAKZQVAKIB-UHFFFAOYSA-N
MW136.12 g/mol
LogP-0.57
Rot. Bonds1

About 5-fluoro-5-(hydroxymethyl)oxolan-3-ol

5-fluoro-5-(hydroxymethyl)oxolan-3-ol (PubChem CID 150245788) has the molecular formula C5H9FO3 and a molecular weight of 136.12 g/mol. Its IUPAC name is 5-fluoro-5-(hydroxymethyl)oxolan-3-ol.

Molecular Properties

Compound Name5-fluoro-5-(hydroxymethyl)oxolan-3-ol
PubChem CID150245788
Molecular FormulaC5H9FO3
Molecular Weight136.12 g/mol
Exact Mass136.05
IUPAC Name5-fluoro-5-(hydroxymethyl)oxolan-3-ol
SMILESOCC1(F)CC(O)CO1
InChIInChI=1S/C5H9FO3/c6-5(3-7)1-4(8)2-9-5/h4,7-8H,1-3H2
InChIKeyFYMFEAKZQVAKIB-UHFFFAOYSA-N
XLogP-0.57
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.12
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-fluoro-5-(hydroxymethyl)oxolan-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(2S)-2-fluorooxiran-2-yl]methanol
CID 141069449
oxolane-2,2,4-triol
CID 20742692
4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol
CID 162845079
(3S)-1-oxaspiro[4.4]nonan-3-ol
CID 124707938
(2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol
CID 101077453
(1R,4R,5R,7S)-5-fluoro-1-(hydroxymethyl)-2-oxabicyclo[2.2.1]heptan-7-ol
CID 59483209
(1R,4S,5R,7S)-5-fluoro-1-(hydroxymethyl)-2-oxabicyclo[2.2.1]heptan-7-ol
CID 140553561
2-(hydroxymethyl)oxane-2,3,5-triol
CID 91319547
(2S,3S,4R,5S)-2-fluoro-2-(hydroxymethyl)oxane-3,4,5-triol
CID 78226014
2-(hydroxymethyl)oxolane-2,4-diol;1,4,5-trihydroxypentan-2-one
CID 171935199
(7S)-5-oxa-2-azaspiro[3.4]octan-7-ol;2,2,2-trifluoroacetic acid
CID 146273108
3-(5,5-dimethyloxolan-3-yl)-2-methylbutan-1-ol
CID 91440624

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-5-(hydroxymethyl)oxolan-3-ol?
The IUPAC name of 5-fluoro-5-(hydroxymethyl)oxolan-3-ol (CID 150245788) is 5-fluoro-5-(hydroxymethyl)oxolan-3-ol.
What is the SMILES notation for 5-fluoro-5-(hydroxymethyl)oxolan-3-ol?
The canonical SMILES for 5-fluoro-5-(hydroxymethyl)oxolan-3-ol is OCC1(F)CC(O)CO1.
What is the InChIKey of 5-fluoro-5-(hydroxymethyl)oxolan-3-ol?
The InChIKey is FYMFEAKZQVAKIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9FO3/c6-5(3-7)1-4(8)2-9-5/h4,7-8H,1-3H2.
What are the key properties of 5-fluoro-5-(hydroxymethyl)oxolan-3-ol?
5-fluoro-5-(hydroxymethyl)oxolan-3-ol has a molecular weight of 136.12 g/mol, XLogP of -0.57, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-5-(hydroxymethyl)oxolan-3-ol is sourced from PubChem (CID 150245788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).