4-butyl-2,3-dihydrofuran

C8H14O — CID 19883176

IUPAC4-butyl-2,3-dihydrofuran
SMILESCCCCC1=COCC1
InChIInChI=1S/C8H14O/c1-2-3-4-8-5-6-9-7-8/h7H,2-6H2,1H3
InChIKeySTJJBKFTKCSYGL-UHFFFAOYSA-N
MW126.20 g/mol
LogP2.48
Rot. Bonds3

About 4-butyl-2,3-dihydrofuran

4-butyl-2,3-dihydrofuran (PubChem CID 19883176) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is 4-butyl-2,3-dihydrofuran.

Molecular Properties

Compound Name4-butyl-2,3-dihydrofuran
PubChem CID19883176
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name4-butyl-2,3-dihydrofuran
SMILESCCCCC1=COCC1
InChIInChI=1S/C8H14O/c1-2-3-4-8-5-6-9-7-8/h7H,2-6H2,1H3
InChIKeySTJJBKFTKCSYGL-UHFFFAOYSA-N
XLogP2.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-butyl-2,3-dihydrofuran?
The IUPAC name of 4-butyl-2,3-dihydrofuran (CID 19883176) is 4-butyl-2,3-dihydrofuran.
What is the SMILES notation for 4-butyl-2,3-dihydrofuran?
The canonical SMILES for 4-butyl-2,3-dihydrofuran is CCCCC1=COCC1.
What is the InChIKey of 4-butyl-2,3-dihydrofuran?
The InChIKey is STJJBKFTKCSYGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c1-2-3-4-8-5-6-9-7-8/h7H,2-6H2,1H3.
What are the key properties of 4-butyl-2,3-dihydrofuran?
4-butyl-2,3-dihydrofuran has a molecular weight of 126.20 g/mol, XLogP of 2.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-2,3-dihydrofuran is sourced from PubChem (CID 19883176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).