6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan

C9H16O2 — CID 69011247

IUPAC6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan
SMILESCCOC12CCCC1CCO2
InChIInChI=1S/C9H16O2/c1-2-10-9-6-3-4-8(9)5-7-11-9/h8H,2-7H2,1H3
InChIKeyLCQNYQAQSJTRCX-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.94
Rot. Bonds2

About 6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan

6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan (PubChem CID 69011247) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan.

Molecular Properties

Compound Name6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan
PubChem CID69011247
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan
SMILESCCOC12CCCC1CCO2
InChIInChI=1S/C9H16O2/c1-2-10-9-6-3-4-8(9)5-7-11-9/h8H,2-7H2,1H3
InChIKeyLCQNYQAQSJTRCX-UHFFFAOYSA-N
XLogP1.94
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan?
The IUPAC name of 6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan (CID 69011247) is 6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan.
What is the SMILES notation for 6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan?
The canonical SMILES for 6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan is CCOC12CCCC1CCO2.
What is the InChIKey of 6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan?
The InChIKey is LCQNYQAQSJTRCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-2-10-9-6-3-4-8(9)5-7-11-9/h8H,2-7H2,1H3.
What are the key properties of 6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan?
6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan has a molecular weight of 156.22 g/mol, XLogP of 1.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6a-ethoxy-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan is sourced from PubChem (CID 69011247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).