3-propylfuran

C7H10O — CID 12768224

IUPAC3-propylfuran
SMILESCCCc1ccoc1
InChIInChI=1S/C7H10O/c1-2-3-7-4-5-8-6-7/h4-6H,2-3H2,1H3
InChIKeyKEWDQLOCPSUFML-UHFFFAOYSA-N
MW110.16 g/mol
LogP2.23
Rot. Bonds2

About 3-propylfuran

3-propylfuran (PubChem CID 12768224) has the molecular formula C7H10O and a molecular weight of 110.16 g/mol. Its IUPAC name is 3-propylfuran.

Molecular Properties

Compound Name3-propylfuran
PubChem CID12768224
Molecular FormulaC7H10O
Molecular Weight110.16 g/mol
Exact Mass110.07
IUPAC Name3-propylfuran
SMILESCCCc1ccoc1
InChIInChI=1S/C7H10O/c1-2-3-7-4-5-8-6-7/h4-6H,2-3H2,1H3
InChIKeyKEWDQLOCPSUFML-UHFFFAOYSA-N
XLogP2.23
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-propylfuran?
The IUPAC name of 3-propylfuran (CID 12768224) is 3-propylfuran.
What is the SMILES notation for 3-propylfuran?
The canonical SMILES for 3-propylfuran is CCCc1ccoc1.
What is the InChIKey of 3-propylfuran?
The InChIKey is KEWDQLOCPSUFML-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O/c1-2-3-7-4-5-8-6-7/h4-6H,2-3H2,1H3.
What are the key properties of 3-propylfuran?
3-propylfuran has a molecular weight of 110.16 g/mol, XLogP of 2.23, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propylfuran is sourced from PubChem (CID 12768224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).