2-nonyl-2,5-dihydrofuran

C13H24O — CID 11217821

IUPAC2-nonyl-2,5-dihydrofuran
SMILESCCCCCCCCCC1C=CCO1
InChIInChI=1S/C13H24O/c1-2-3-4-5-6-7-8-10-13-11-9-12-14-13/h9,11,13H,2-8,10,12H2,1H3
InChIKeyBAGCTDMZBVVWJF-UHFFFAOYSA-N
MW196.33 g/mol
LogP4.08
Rot. Bonds8

About 2-nonyl-2,5-dihydrofuran

2-nonyl-2,5-dihydrofuran (PubChem CID 11217821) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is 2-nonyl-2,5-dihydrofuran.

Molecular Properties

Compound Name2-nonyl-2,5-dihydrofuran
PubChem CID11217821
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name2-nonyl-2,5-dihydrofuran
SMILESCCCCCCCCCC1C=CCO1
InChIInChI=1S/C13H24O/c1-2-3-4-5-6-7-8-10-13-11-9-12-14-13/h9,11,13H,2-8,10,12H2,1H3
InChIKeyBAGCTDMZBVVWJF-UHFFFAOYSA-N
XLogP4.08
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.33
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(6E,10E,14E)-3,6,10,14-tetramethyl-2,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan
CID 23425614
trans-11S,12S-Epoxy-6Z,9Z-heneicosadiene
CID 10494907
9-Oxabicyclo[4.2.1]non-7-ene
CID 140727
(2R)-3-methyl-2-(3-methylbut-3-enyl)-2,5-dihydrofuran
CID 163015296
(2R,3R)-2-hex-5-enyl-3-[(1E,7E)-nona-1,7-dien-3,5-diynyl]oxirane
CID 163189087
1-Nonen-3-ol, methyl ether
CID 12563924
3-Pentyl-2,5-dihydrofuran
CID 15647309
3-(Propan-2-yloxy)cyclohexene
CID 230450
(2R)-2-(cyclohexen-1-yl)-2,5-dihydrofuran
CID 10012080
2-butyl-5,5-dimethyl-3-prop-2-enyl-2H-furan
CID 10888822
2-Hexyl-4-methyl-3-prop-2-enyl-2,5-dihydrofuran
CID 10943714
2-Hexyl-3-prop-2-enyl-2,5-dihydrofuran
CID 11030687

Frequently Asked Questions

What is the IUPAC name of 2-nonyl-2,5-dihydrofuran?
The IUPAC name of 2-nonyl-2,5-dihydrofuran (CID 11217821) is 2-nonyl-2,5-dihydrofuran.
What is the SMILES notation for 2-nonyl-2,5-dihydrofuran?
The canonical SMILES for 2-nonyl-2,5-dihydrofuran is CCCCCCCCCC1C=CCO1.
What is the InChIKey of 2-nonyl-2,5-dihydrofuran?
The InChIKey is BAGCTDMZBVVWJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O/c1-2-3-4-5-6-7-8-10-13-11-9-12-14-13/h9,11,13H,2-8,10,12H2,1H3.
What are the key properties of 2-nonyl-2,5-dihydrofuran?
2-nonyl-2,5-dihydrofuran has a molecular weight of 196.33 g/mol, XLogP of 4.08, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-nonyl-2,5-dihydrofuran is sourced from PubChem (CID 11217821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).