(2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol

C6H9FO3 — CID 123711593

IUPAC(2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol
SMILESOC[C@H]1OCC(=CF)[C@@H]1O
InChIInChI=1S/C6H9FO3/c7-1-4-3-10-5(2-8)6(4)9/h1,5-6,8-9H,2-3H2/t5-,6+/m1/s1
InChIKeyZOGJHQXHRMYKAH-RITPCOANSA-N
MW148.13 g/mol
LogP-0.41
Rot. Bonds1

About (2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol

(2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol (PubChem CID 123711593) has the molecular formula C6H9FO3 and a molecular weight of 148.13 g/mol. Its IUPAC name is (2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol.

Molecular Properties

Compound Name(2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol
PubChem CID123711593
Molecular FormulaC6H9FO3
Molecular Weight148.13 g/mol
Exact Mass148.05
IUPAC Name(2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol
SMILESOC[C@H]1OCC(=CF)[C@@H]1O
InChIInChI=1S/C6H9FO3/c7-1-4-3-10-5(2-8)6(4)9/h1,5-6,8-9H,2-3H2/t5-,6+/m1/s1
InChIKeyZOGJHQXHRMYKAH-RITPCOANSA-N
XLogP-0.41
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.13
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-4-methylideneoxolan-3-ol
CID 89323980
(2E,3S,4R,5S)-2-(fluoromethylidene)-5-methyloxolane-3,4-diol
CID 134853658
(2Z,3S,4R,5S)-2-(fluoromethylidene)-5-methyloxolane-3,4-diol
CID 134969754
4-Methylenetetrahydrofurfuryl alcohol
CID 129667874
(2R,3S)-4-(fluoromethyl)-2-(hydroxymethyl)-2,3-dihydrofuran-3-ol
CID 56614670
CID 57693247
CID 57693247
(2R,3S,4E)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol
CID 58308064
(2R,3E,4S,5R)-3-(fluoromethylidene)-5-(hydroxymethyl)oxolane-2,4-diol
CID 59096586
(2R,3S,4E,5S)-4-(fluoromethylidene)-2-(hydroxymethyl)-5-methyloxolan-3-ol
CID 59263723
(2R,3S,4Z,5S)-4-(fluoromethylidene)-2-(hydroxymethyl)-5-methyloxolan-3-ol
CID 59796321
[(2S,4Z,5S)-4-(fluoromethylidene)-5-methyloxolan-2-yl]methanol
CID 68034797
[(2S,4E,5S)-4-(fluoromethylidene)-5-methyloxolan-2-yl]methanol
CID 89043739

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol?
The IUPAC name of (2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol (CID 123711593) is (2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol.
What is the SMILES notation for (2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol?
The canonical SMILES for (2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol is OC[C@H]1OCC(=CF)[C@@H]1O.
What is the InChIKey of (2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol?
The InChIKey is ZOGJHQXHRMYKAH-RITPCOANSA-N. The full InChI is InChI=1S/C6H9FO3/c7-1-4-3-10-5(2-8)6(4)9/h1,5-6,8-9H,2-3H2/t5-,6+/m1/s1.
What are the key properties of (2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol?
(2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol has a molecular weight of 148.13 g/mol, XLogP of -0.41, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-4-(fluoromethylidene)-2-(hydroxymethyl)oxolan-3-ol is sourced from PubChem (CID 123711593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).