(2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate

C10H10O5 — CID 24838301

IUPAC(2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate
SMILESCCC(=O)OC1OCC=C2OC(=O)C=C21
InChIInChI=1S/C10H10O5/c1-2-8(11)15-10-6-5-9(12)14-7(6)3-4-13-10/h3,5,10H,2,4H2,1H3
InChIKeyLGSGSUSAZLKJKA-UHFFFAOYSA-N
MW210.18 g/mol
LogP0.66
Rot. Bonds2

About (2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate

(2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate (PubChem CID 24838301) has the molecular formula C10H10O5 and a molecular weight of 210.18 g/mol. Its IUPAC name is (2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate.

Molecular Properties

Compound Name(2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate
PubChem CID24838301
Molecular FormulaC10H10O5
Molecular Weight210.18 g/mol
Exact Mass210.05
IUPAC Name(2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate
SMILESCCC(=O)OC1OCC=C2OC(=O)C=C21
InChIInChI=1S/C10H10O5/c1-2-8(11)15-10-6-5-9(12)14-7(6)3-4-13-10/h3,5,10H,2,4H2,1H3
InChIKeyLGSGSUSAZLKJKA-UHFFFAOYSA-N
XLogP0.66
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.18
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate?
The IUPAC name of (2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate (CID 24838301) is (2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate.
What is the SMILES notation for (2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate?
The canonical SMILES for (2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate is CCC(=O)OC1OCC=C2OC(=O)C=C21.
What is the InChIKey of (2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate?
The InChIKey is LGSGSUSAZLKJKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O5/c1-2-8(11)15-10-6-5-9(12)14-7(6)3-4-13-10/h3,5,10H,2,4H2,1H3.
What are the key properties of (2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate?
(2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate has a molecular weight of 210.18 g/mol, XLogP of 0.66, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxo-4,6-dihydrofuro[3,2-c]pyran-4-yl) propanoate is sourced from PubChem (CID 24838301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).