3-[fluoro(methoxy)methyl]oxetane

C5H9FO2 — CID 70631872

IUPAC3-[fluoro(methoxy)methyl]oxetane
SMILESCOC(F)C1COC1
InChIInChI=1S/C5H9FO2/c1-7-5(6)4-2-8-3-4/h4-5H,2-3H2,1H3
InChIKeyGFZWIKRPHNNTOU-UHFFFAOYSA-N
MW120.12 g/mol
LogP0.57
Rot. Bonds2

About 3-[fluoro(methoxy)methyl]oxetane

3-[fluoro(methoxy)methyl]oxetane (PubChem CID 70631872) has the molecular formula C5H9FO2 and a molecular weight of 120.12 g/mol. Its IUPAC name is 3-[fluoro(methoxy)methyl]oxetane.

Molecular Properties

Compound Name3-[fluoro(methoxy)methyl]oxetane
PubChem CID70631872
Molecular FormulaC5H9FO2
Molecular Weight120.12 g/mol
Exact Mass120.06
IUPAC Name3-[fluoro(methoxy)methyl]oxetane
SMILESCOC(F)C1COC1
InChIInChI=1S/C5H9FO2/c1-7-5(6)4-2-8-3-4/h4-5H,2-3H2,1H3
InChIKeyGFZWIKRPHNNTOU-UHFFFAOYSA-N
XLogP0.57
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.12
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 13827493
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CID 20063135
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CID 91030892
CID 91030892
CID 144798635
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CID 158538052
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CID 162747020
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CID 164606363
CID 164606363

Frequently Asked Questions

What is the IUPAC name of 3-[fluoro(methoxy)methyl]oxetane?
The IUPAC name of 3-[fluoro(methoxy)methyl]oxetane (CID 70631872) is 3-[fluoro(methoxy)methyl]oxetane.
What is the SMILES notation for 3-[fluoro(methoxy)methyl]oxetane?
The canonical SMILES for 3-[fluoro(methoxy)methyl]oxetane is COC(F)C1COC1.
What is the InChIKey of 3-[fluoro(methoxy)methyl]oxetane?
The InChIKey is GFZWIKRPHNNTOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9FO2/c1-7-5(6)4-2-8-3-4/h4-5H,2-3H2,1H3.
What are the key properties of 3-[fluoro(methoxy)methyl]oxetane?
3-[fluoro(methoxy)methyl]oxetane has a molecular weight of 120.12 g/mol, XLogP of 0.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[fluoro(methoxy)methyl]oxetane is sourced from PubChem (CID 70631872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).