2,3-dihydrofuran-5-olate

C4H5O2- — CID 91156472

IUPAC2,3-dihydrofuran-5-olate
SMILES[O-]C1=CCCO1
InChIInChI=1S/C4H6O2/c5-4-2-1-3-6-4/h2,5H,1,3H2/p-1
InChIKeyYKCIYANSMGFYDE-UHFFFAOYSA-M
MW85.08 g/mol
LogP-0.39
Rot. Bonds

About 2,3-dihydrofuran-5-olate

2,3-dihydrofuran-5-olate (PubChem CID 91156472) has the molecular formula C4H5O2- and a molecular weight of 85.08 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-olate.

Molecular Properties

Compound Name2,3-dihydrofuran-5-olate
PubChem CID91156472
Molecular FormulaC4H5O2-
Molecular Weight85.08 g/mol
Exact Mass85.03
IUPAC Name2,3-dihydrofuran-5-olate
SMILES[O-]C1=CCCO1
InChIInChI=1S/C4H6O2/c5-4-2-1-3-6-4/h2,5H,1,3H2/p-1
InChIKeyYKCIYANSMGFYDE-UHFFFAOYSA-M
XLogP-0.39
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50085.08
LogP ≤ 5-0.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-olate?
The IUPAC name of 2,3-dihydrofuran-5-olate (CID 91156472) is 2,3-dihydrofuran-5-olate.
What is the SMILES notation for 2,3-dihydrofuran-5-olate?
The canonical SMILES for 2,3-dihydrofuran-5-olate is [O-]C1=CCCO1.
What is the InChIKey of 2,3-dihydrofuran-5-olate?
The InChIKey is YKCIYANSMGFYDE-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H6O2/c5-4-2-1-3-6-4/h2,5H,1,3H2/p-1.
What are the key properties of 2,3-dihydrofuran-5-olate?
2,3-dihydrofuran-5-olate has a molecular weight of 85.08 g/mol, XLogP of -0.39, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-olate is sourced from PubChem (CID 91156472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).