5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran

C15H24O — CID 14263841

IUPAC5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran
SMILESCC(C)=CCC/C(C)=C/CCC1=CCCO1
InChIInChI=1S/C15H24O/c1-13(2)7-4-8-14(3)9-5-10-15-11-6-12-16-15/h7,9,11H,4-6,8,10,12H2,1-3H3/b14-9+
InChIKeyPLNYRGLWFFPAGE-NTEUORMPSA-N
MW220.36 g/mol
LogP4.76
Rot. Bonds6

About 5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran

5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran (PubChem CID 14263841) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran.

Molecular Properties

Compound Name5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran
PubChem CID14263841
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran
SMILESCC(C)=CCC/C(C)=C/CCC1=CCCO1
InChIInChI=1S/C15H24O/c1-13(2)7-4-8-14(3)9-5-10-15-11-6-12-16-15/h7,9,11H,4-6,8,10,12H2,1-3H3/b14-9+
InChIKeyPLNYRGLWFFPAGE-NTEUORMPSA-N
XLogP4.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.76
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 5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran?
The IUPAC name of 5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran (CID 14263841) is 5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran.
What is the SMILES notation for 5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran?
The canonical SMILES for 5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran is CC(C)=CCC/C(C)=C/CCC1=CCCO1.
What is the InChIKey of 5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran?
The InChIKey is PLNYRGLWFFPAGE-NTEUORMPSA-N. The full InChI is InChI=1S/C15H24O/c1-13(2)7-4-8-14(3)9-5-10-15-11-6-12-16-15/h7,9,11H,4-6,8,10,12H2,1-3H3/b14-9+.
What are the key properties of 5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran?
5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran has a molecular weight of 220.36 g/mol, XLogP of 4.76, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,3-dihydrofuran is sourced from PubChem (CID 14263841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).