3,5-dihydro-2H-furan-5-ide

C4H5O- — CID 100985205

IUPAC3,5-dihydro-2H-furan-5-ide
SMILES[C-]1=CCCO1
InChIInChI=1S/C4H5O/c1-2-4-5-3-1/h1H,2,4H2/q-1
InChIKeyCWFJNNXKXBWKAX-UHFFFAOYSA-N
MW69.08 g/mol
LogP0.72
Rot. Bonds

About 3,5-dihydro-2H-furan-5-ide

3,5-dihydro-2H-furan-5-ide (PubChem CID 100985205) has the molecular formula C4H5O- and a molecular weight of 69.08 g/mol. Its IUPAC name is 3,5-dihydro-2H-furan-5-ide.

Molecular Properties

Compound Name3,5-dihydro-2H-furan-5-ide
PubChem CID100985205
Molecular FormulaC4H5O-
Molecular Weight69.08 g/mol
Exact Mass69.03
IUPAC Name3,5-dihydro-2H-furan-5-ide
SMILES[C-]1=CCCO1
InChIInChI=1S/C4H5O/c1-2-4-5-3-1/h1H,2,4H2/q-1
InChIKeyCWFJNNXKXBWKAX-UHFFFAOYSA-N
XLogP0.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50069.08
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,5-dihydro-2H-furan-5-ide?
The IUPAC name of 3,5-dihydro-2H-furan-5-ide (CID 100985205) is 3,5-dihydro-2H-furan-5-ide.
What is the SMILES notation for 3,5-dihydro-2H-furan-5-ide?
The canonical SMILES for 3,5-dihydro-2H-furan-5-ide is [C-]1=CCCO1.
What is the InChIKey of 3,5-dihydro-2H-furan-5-ide?
The InChIKey is CWFJNNXKXBWKAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5O/c1-2-4-5-3-1/h1H,2,4H2/q-1.
What are the key properties of 3,5-dihydro-2H-furan-5-ide?
3,5-dihydro-2H-furan-5-ide has a molecular weight of 69.08 g/mol, XLogP of 0.72, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dihydro-2H-furan-5-ide is sourced from PubChem (CID 100985205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).