2-deuterio-2,3-dihydrofuran

C4H6O — CID 90919920

IUPAC2-deuterio-2,3-dihydrofuran
SMILES[2H]C1CC=CO1
InChIInChI=1S/C4H6O/c1-2-4-5-3-1/h1,3H,2,4H2/i4D
InChIKeyJKTCBAGSMQIFNL-QYKNYGDISA-N
MW71.10 g/mol
LogP0.92
Rot. Bonds

About 2-deuterio-2,3-dihydrofuran

2-deuterio-2,3-dihydrofuran (PubChem CID 90919920) has the molecular formula C4H6O and a molecular weight of 71.10 g/mol. Its IUPAC name is 2-deuterio-2,3-dihydrofuran.

Molecular Properties

Compound Name2-deuterio-2,3-dihydrofuran
PubChem CID90919920
Molecular FormulaC4H6O
Molecular Weight71.10 g/mol
Exact Mass71.05
IUPAC Name2-deuterio-2,3-dihydrofuran
SMILES[2H]C1CC=CO1
InChIInChI=1S/C4H6O/c1-2-4-5-3-1/h1,3H,2,4H2/i4D
InChIKeyJKTCBAGSMQIFNL-QYKNYGDISA-N
XLogP0.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50071.10
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-deuterio-2,3-dihydrofuran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-deuterio-2,3-dihydrofuran?
The IUPAC name of 2-deuterio-2,3-dihydrofuran (CID 90919920) is 2-deuterio-2,3-dihydrofuran.
What is the SMILES notation for 2-deuterio-2,3-dihydrofuran?
The canonical SMILES for 2-deuterio-2,3-dihydrofuran is [2H]C1CC=CO1.
What is the InChIKey of 2-deuterio-2,3-dihydrofuran?
The InChIKey is JKTCBAGSMQIFNL-QYKNYGDISA-N. The full InChI is InChI=1S/C4H6O/c1-2-4-5-3-1/h1,3H,2,4H2/i4D.
What are the key properties of 2-deuterio-2,3-dihydrofuran?
2-deuterio-2,3-dihydrofuran has a molecular weight of 71.10 g/mol, XLogP of 0.92, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-deuterio-2,3-dihydrofuran is sourced from PubChem (CID 90919920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).