[(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol

C7H13FO3 — CID 11030161

IUPAC[(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol
SMILESCCOC1C[C@H](F)[C@@H](CO)O1
InChIInChI=1S/C7H13FO3/c1-2-10-7-3-5(8)6(4-9)11-7/h5-7,9H,2-4H2,1H3/t5-,6+,7?/m0/s1
InChIKeyPQGZPQRRKJXMHX-GFCOJPQKSA-N
MW164.18 g/mol
LogP0.47
Rot. Bonds3

About [(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol

[(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol (PubChem CID 11030161) has the molecular formula C7H13FO3 and a molecular weight of 164.18 g/mol. Its IUPAC name is [(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol.

Molecular Properties

Compound Name[(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol
PubChem CID11030161
Molecular FormulaC7H13FO3
Molecular Weight164.18 g/mol
Exact Mass164.08
IUPAC Name[(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol
SMILESCCOC1C[C@H](F)[C@@H](CO)O1
InChIInChI=1S/C7H13FO3/c1-2-10-7-3-5(8)6(4-9)11-7/h5-7,9H,2-4H2,1H3/t5-,6+,7?/m0/s1
InChIKeyPQGZPQRRKJXMHX-GFCOJPQKSA-N
XLogP0.47
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.18
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2R,3S,5R)-3-chloro-5-ethoxyoxolan-2-yl]methanol
CID 130870867
(2R,3S,6R)-6-ethoxy-2-(hydroxymethyl)oxan-3-ol
CID 54321691
(3S,6S)-6-[(6-ethoxy-4-hydroxyoxan-2-yl)methoxy]-2-(hydroxymethyl)oxane-3,4-diol
CID 177228824
2-(5-ethoxy-3-fluorooxolan-2-yl)triazole
CID 174519090
2-(hydroxymethyl)-6-propoxyoxane-3,4-diol
CID 154980808
(3-ethoxy-5-methyloxolan-2-yl)methanol
CID 59687260
5-chloro-6-ethoxy-1-[(2R,4S,5R)-4-fluoro-5-(hydroxymethyl)oxolan-2-yl]-1,3-diazinane-2,4-dione
CID 67177164
2-ethoxy-6-(hydroxymethyl)oxane-3,5-diol
CID 18974249
(3R,4R,5S,6R)-2-ethoxy-5-(18F)fluoro-6-(hydroxymethyl)oxane-3,4-diol
CID 15949155
(2R,5S)-5-ethoxy-2,6-bis(hydroxymethyl)oxane-3,4-diol
CID 174113767
(2S,3S,4S,5S,6R)-3-ethoxy-6-(hydroxymethyl)oxane-2,4,5-triol
CID 70232316
(2R,3S,4R,6R)-6-ethoxy-2-methyloxane-3,4-diol
CID 11030343

Frequently Asked Questions

What is the IUPAC name of [(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol?
The IUPAC name of [(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol (CID 11030161) is [(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol.
What is the SMILES notation for [(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol?
The canonical SMILES for [(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol is CCOC1C[C@H](F)[C@@H](CO)O1.
What is the InChIKey of [(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol?
The InChIKey is PQGZPQRRKJXMHX-GFCOJPQKSA-N. The full InChI is InChI=1S/C7H13FO3/c1-2-10-7-3-5(8)6(4-9)11-7/h5-7,9H,2-4H2,1H3/t5-,6+,7?/m0/s1.
What are the key properties of [(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol?
[(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol has a molecular weight of 164.18 g/mol, XLogP of 0.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3S)-5-ethoxy-3-fluorooxolan-2-yl]methanol is sourced from PubChem (CID 11030161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).