6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan

C7H11FO3 — CID 123195939

IUPAC6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
SMILESCOC1COC2C(F)COC12
InChIInChI=1S/C7H11FO3/c1-9-5-3-11-6-4(8)2-10-7(5)6/h4-7H,2-3H2,1H3
InChIKeyIYXDYHHWHUJAAI-UHFFFAOYSA-N
MW162.16 g/mol
LogP0.14
Rot. Bonds1

About 6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan

6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan (PubChem CID 123195939) has the molecular formula C7H11FO3 and a molecular weight of 162.16 g/mol. Its IUPAC name is 6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan.

Molecular Properties

Compound Name6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
PubChem CID123195939
Molecular FormulaC7H11FO3
Molecular Weight162.16 g/mol
Exact Mass162.07
IUPAC Name6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
SMILESCOC1COC2C(F)COC12
InChIInChI=1S/C7H11FO3/c1-9-5-3-11-6-4(8)2-10-7(5)6/h4-7H,2-3H2,1H3
InChIKeyIYXDYHHWHUJAAI-UHFFFAOYSA-N
XLogP0.14
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.16
LogP ≤ 50.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan?
The IUPAC name of 6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan (CID 123195939) is 6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan.
What is the SMILES notation for 6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan?
The canonical SMILES for 6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan is COC1COC2C(F)COC12.
What is the InChIKey of 6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan?
The InChIKey is IYXDYHHWHUJAAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FO3/c1-9-5-3-11-6-4(8)2-10-7(5)6/h4-7H,2-3H2,1H3.
What are the key properties of 6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan?
6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan has a molecular weight of 162.16 g/mol, XLogP of 0.14, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-methoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan is sourced from PubChem (CID 123195939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).