lithium 2,3-dihydrofuran-5-olate

C4H5LiO2 — CID 23663748

IUPAClithium 2,3-dihydrofuran-5-olate
SMILES[Li+].[O-]C1=CCCO1
InChIInChI=1S/C4H6O2.Li/c5-4-2-1-3-6-4;/h2,5H,1,3H2;/q;+1/p-1
InChIKeyDJYREAKYPOAZHM-UHFFFAOYSA-M
MW92.02 g/mol
LogP-3.39
Rot. Bonds

About lithium 2,3-dihydrofuran-5-olate

lithium 2,3-dihydrofuran-5-olate (PubChem CID 23663748) has the molecular formula C4H5LiO2 and a molecular weight of 92.02 g/mol. Its IUPAC name is lithium 2,3-dihydrofuran-5-olate.

Molecular Properties

Compound Namelithium 2,3-dihydrofuran-5-olate
PubChem CID23663748
Molecular FormulaC4H5LiO2
Molecular Weight92.02 g/mol
Exact Mass92.04
IUPAC Namelithium 2,3-dihydrofuran-5-olate
SMILES[Li+].[O-]C1=CCCO1
InChIInChI=1S/C4H6O2.Li/c5-4-2-1-3-6-4;/h2,5H,1,3H2;/q;+1/p-1
InChIKeyDJYREAKYPOAZHM-UHFFFAOYSA-M
XLogP-3.39
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.02
LogP ≤ 5-3.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of lithium 2,3-dihydrofuran-5-olate?
The IUPAC name of lithium 2,3-dihydrofuran-5-olate (CID 23663748) is lithium 2,3-dihydrofuran-5-olate.
What is the SMILES notation for lithium 2,3-dihydrofuran-5-olate?
The canonical SMILES for lithium 2,3-dihydrofuran-5-olate is [Li+].[O-]C1=CCCO1.
What is the InChIKey of lithium 2,3-dihydrofuran-5-olate?
The InChIKey is DJYREAKYPOAZHM-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H6O2.Li/c5-4-2-1-3-6-4;/h2,5H,1,3H2;/q;+1/p-1.
What are the key properties of lithium 2,3-dihydrofuran-5-olate?
lithium 2,3-dihydrofuran-5-olate has a molecular weight of 92.02 g/mol, XLogP of -3.39, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 2,3-dihydrofuran-5-olate is sourced from PubChem (CID 23663748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).