furan

C4H4O — CID 8029

IUPACfuran
SMILESc1ccoc1
InChIInChI=1S/C4H4O/c1-2-4-5-3-1/h1-4H
InChIKeyYLQBMQCUIZJEEH-UHFFFAOYSA-N
MW68.08 g/mol
LogP1.28
Rot. Bonds

About furan

furan (PubChem CID 8029) has the molecular formula C4H4O and a molecular weight of 68.08 g/mol. Its IUPAC name is furan.

Molecular Properties

Compound Namefuran
PubChem CID8029
Molecular FormulaC4H4O
Molecular Weight68.08 g/mol
Exact Mass68.03
IUPAC Namefuran
SMILESc1ccoc1
InChIInChI=1S/C4H4O/c1-2-4-5-3-1/h1-4H
InChIKeyYLQBMQCUIZJEEH-UHFFFAOYSA-N
XLogP1.28
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50068.08
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of furan?
The IUPAC name of furan (CID 8029) is furan.
What is the SMILES notation for furan?
The canonical SMILES for furan is c1ccoc1.
What is the InChIKey of furan?
The InChIKey is YLQBMQCUIZJEEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4O/c1-2-4-5-3-1/h1-4H.
What are the key properties of furan?
furan has a molecular weight of 68.08 g/mol, XLogP of 1.28, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for furan is sourced from PubChem (CID 8029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).