2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol

C6H10O3 — CID 85176245

IUPAC2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol
SMILESOC1COC2COCC12
InChIInChI=1S/C6H10O3/c7-5-2-9-6-3-8-1-4(5)6/h4-7H,1-3H2
InChIKeyMCLVGSITPUXMEV-UHFFFAOYSA-N
MW130.14 g/mol
LogP-0.61
Rot. Bonds

About 2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol

2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol (PubChem CID 85176245) has the molecular formula C6H10O3 and a molecular weight of 130.14 g/mol. Its IUPAC name is 2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol.

Molecular Properties

Compound Name2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol
PubChem CID85176245
Molecular FormulaC6H10O3
Molecular Weight130.14 g/mol
Exact Mass130.06
IUPAC Name2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol
SMILESOC1COC2COCC12
InChIInChI=1S/C6H10O3/c7-5-2-9-6-3-8-1-4(5)6/h4-7H,1-3H2
InChIKeyMCLVGSITPUXMEV-UHFFFAOYSA-N
XLogP-0.61
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.14
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol?
The IUPAC name of 2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol (CID 85176245) is 2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol.
What is the SMILES notation for 2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol?
The canonical SMILES for 2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol is OC1COC2COCC12.
What is the InChIKey of 2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol?
The InChIKey is MCLVGSITPUXMEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O3/c7-5-2-9-6-3-8-1-4(5)6/h4-7H,1-3H2.
What are the key properties of 2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol?
2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol has a molecular weight of 130.14 g/mol, XLogP of -0.61, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-ol is sourced from PubChem (CID 85176245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).