4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one

C14H12O8 — CID 21192277

IUPAC4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one
SMILESO=C1C=C2C(=CCOC2O)O1.O=C1C=C2C(=CCOC2O)O1
InChIInChI=1S/2C7H6O4/c2*8-6-3-4-5(11-6)1-2-10-7(4)9/h2*1,3,7,9H,2H2
InChIKeyGLGOHHQZSBEHLR-UHFFFAOYSA-N
MW308.24 g/mol
LogP-0.60
Rot. Bonds

About 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one

4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one (PubChem CID 21192277) has the molecular formula C14H12O8 and a molecular weight of 308.24 g/mol. Its IUPAC name is 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one.

Molecular Properties

Compound Name4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one
PubChem CID21192277
Molecular FormulaC14H12O8
Molecular Weight308.24 g/mol
Exact Mass308.05
IUPAC Name4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one
SMILESO=C1C=C2C(=CCOC2O)O1.O=C1C=C2C(=CCOC2O)O1
InChIInChI=1S/2C7H6O4/c2*8-6-3-4-5(11-6)1-2-10-7(4)9/h2*1,3,7,9H,2H2
InChIKeyGLGOHHQZSBEHLR-UHFFFAOYSA-N
XLogP-0.60
TPSA111.52 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.24
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one?
The IUPAC name of 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one (CID 21192277) is 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one.
What is the SMILES notation for 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one?
The canonical SMILES for 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one is O=C1C=C2C(=CCOC2O)O1.O=C1C=C2C(=CCOC2O)O1.
What is the InChIKey of 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one?
The InChIKey is GLGOHHQZSBEHLR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H6O4/c2*8-6-3-4-5(11-6)1-2-10-7(4)9/h2*1,3,7,9H,2H2.
What are the key properties of 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one?
4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one has a molecular weight of 308.24 g/mol, XLogP of -0.60, 0 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one is sourced from PubChem (CID 21192277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).