2,5-diethylfuran

C8H12O — CID 6428556

IUPAC2,5-diethylfuran
SMILESCCc1ccc(CC)o1
InChIInChI=1S/C8H12O/c1-3-7-5-6-8(4-2)9-7/h5-6H,3-4H2,1-2H3
InChIKeyOKYQOKFZRFUBJX-UHFFFAOYSA-N
MW124.18 g/mol
LogP2.40
Rot. Bonds2

About 2,5-diethylfuran

2,5-diethylfuran (PubChem CID 6428556) has the molecular formula C8H12O and a molecular weight of 124.18 g/mol. Its IUPAC name is 2,5-diethylfuran.

Molecular Properties

Compound Name2,5-diethylfuran
PubChem CID6428556
Molecular FormulaC8H12O
Molecular Weight124.18 g/mol
Exact Mass124.09
IUPAC Name2,5-diethylfuran
SMILESCCc1ccc(CC)o1
InChIInChI=1S/C8H12O/c1-3-7-5-6-8(4-2)9-7/h5-6H,3-4H2,1-2H3
InChIKeyOKYQOKFZRFUBJX-UHFFFAOYSA-N
XLogP2.40
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.18
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,5-diethylfuran?
The IUPAC name of 2,5-diethylfuran (CID 6428556) is 2,5-diethylfuran.
What is the SMILES notation for 2,5-diethylfuran?
The canonical SMILES for 2,5-diethylfuran is CCc1ccc(CC)o1.
What is the InChIKey of 2,5-diethylfuran?
The InChIKey is OKYQOKFZRFUBJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O/c1-3-7-5-6-8(4-2)9-7/h5-6H,3-4H2,1-2H3.
What are the key properties of 2,5-diethylfuran?
2,5-diethylfuran has a molecular weight of 124.18 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethylfuran is sourced from PubChem (CID 6428556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).