2,5-bis(hex-3-enyl)-2,3-dihydrofuran

C16H26O — CID 139662910

IUPAC2,5-bis(hex-3-enyl)-2,3-dihydrofuran
SMILESCCC=CCCC1=CCC(CCC=CCC)O1
InChIInChI=1S/C16H26O/c1-3-5-7-9-11-15-13-14-16(17-15)12-10-8-6-4-2/h5-8,13,16H,3-4,9-12,14H2,1-2H3
InChIKeyZOEMOJRFMRALQJ-UHFFFAOYSA-N
MW234.38 g/mol
LogP5.15
Rot. Bonds8

About 2,5-bis(hex-3-enyl)-2,3-dihydrofuran

2,5-bis(hex-3-enyl)-2,3-dihydrofuran (PubChem CID 139662910) has the molecular formula C16H26O and a molecular weight of 234.38 g/mol. Its IUPAC name is 2,5-bis(hex-3-enyl)-2,3-dihydrofuran.

Molecular Properties

Compound Name2,5-bis(hex-3-enyl)-2,3-dihydrofuran
PubChem CID139662910
Molecular FormulaC16H26O
Molecular Weight234.38 g/mol
Exact Mass234.20
IUPAC Name2,5-bis(hex-3-enyl)-2,3-dihydrofuran
SMILESCCC=CCCC1=CCC(CCC=CCC)O1
InChIInChI=1S/C16H26O/c1-3-5-7-9-11-15-13-14-16(17-15)12-10-8-6-4-2/h5-8,13,16H,3-4,9-12,14H2,1-2H3
InChIKeyZOEMOJRFMRALQJ-UHFFFAOYSA-N
XLogP5.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500234.38
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,5-bis(hex-3-enyl)-2,3-dihydrofuran?
The IUPAC name of 2,5-bis(hex-3-enyl)-2,3-dihydrofuran (CID 139662910) is 2,5-bis(hex-3-enyl)-2,3-dihydrofuran.
What is the SMILES notation for 2,5-bis(hex-3-enyl)-2,3-dihydrofuran?
The canonical SMILES for 2,5-bis(hex-3-enyl)-2,3-dihydrofuran is CCC=CCCC1=CCC(CCC=CCC)O1.
What is the InChIKey of 2,5-bis(hex-3-enyl)-2,3-dihydrofuran?
The InChIKey is ZOEMOJRFMRALQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26O/c1-3-5-7-9-11-15-13-14-16(17-15)12-10-8-6-4-2/h5-8,13,16H,3-4,9-12,14H2,1-2H3.
What are the key properties of 2,5-bis(hex-3-enyl)-2,3-dihydrofuran?
2,5-bis(hex-3-enyl)-2,3-dihydrofuran has a molecular weight of 234.38 g/mol, XLogP of 5.15, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(hex-3-enyl)-2,3-dihydrofuran is sourced from PubChem (CID 139662910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).