2-hexyl-3-methoxy-2,5-dihydrofuran

C11H20O2 — CID 11389794

IUPAC2-hexyl-3-methoxy-2,5-dihydrofuran
SMILESCCCCCCC1OCC=C1OC
InChIInChI=1S/C11H20O2/c1-3-4-5-6-7-11-10(12-2)8-9-13-11/h8,11H,3-7,9H2,1-2H3
InChIKeyXLQBWRHSEGSMFA-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.89
Rot. Bonds6

About 2-hexyl-3-methoxy-2,5-dihydrofuran

2-hexyl-3-methoxy-2,5-dihydrofuran (PubChem CID 11389794) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-hexyl-3-methoxy-2,5-dihydrofuran.

Molecular Properties

Compound Name2-hexyl-3-methoxy-2,5-dihydrofuran
PubChem CID11389794
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name2-hexyl-3-methoxy-2,5-dihydrofuran
SMILESCCCCCCC1OCC=C1OC
InChIInChI=1S/C11H20O2/c1-3-4-5-6-7-11-10(12-2)8-9-13-11/h8,11H,3-7,9H2,1-2H3
InChIKeyXLQBWRHSEGSMFA-UHFFFAOYSA-N
XLogP2.89
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-Methoxy-2-tetradecyl-2,5-dihydrofuran
CID 101895600
2-Hexyl-2,5-dihydrofuran
CID 10855696
2-Heptyl-2,5-dihydrofuran
CID 57702310
4-Ethyl-2-heptyl-2,5-dihydrofuran
CID 57702334
(2-Methoxyethyl)cyclododecenyl ether
CID 70477690
(E)-4-ethenoxyundec-2-ene
CID 10845578
2-Hept-1-en-2-yl-3-methyl-2,5-dihydrofuran
CID 11063019
2-Nonyl-2,5-dihydrofuran
CID 11217821
4-Methyl-2-nonyl-2,5-dihydrofuran
CID 15685962
(2S,6S)-2-(3,3-dimethyl-2H-furan-5-yl)-6-methyloxane
CID 73333010
3-methoxy-2-nonyl-2H-furan-5-one
CID 101474324
2-Ethyl-4-hexyl-2,5-dihydrofuran
CID 101480490

Frequently Asked Questions

What is the IUPAC name of 2-hexyl-3-methoxy-2,5-dihydrofuran?
The IUPAC name of 2-hexyl-3-methoxy-2,5-dihydrofuran (CID 11389794) is 2-hexyl-3-methoxy-2,5-dihydrofuran.
What is the SMILES notation for 2-hexyl-3-methoxy-2,5-dihydrofuran?
The canonical SMILES for 2-hexyl-3-methoxy-2,5-dihydrofuran is CCCCCCC1OCC=C1OC.
What is the InChIKey of 2-hexyl-3-methoxy-2,5-dihydrofuran?
The InChIKey is XLQBWRHSEGSMFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-4-5-6-7-11-10(12-2)8-9-13-11/h8,11H,3-7,9H2,1-2H3.
What are the key properties of 2-hexyl-3-methoxy-2,5-dihydrofuran?
2-hexyl-3-methoxy-2,5-dihydrofuran has a molecular weight of 184.28 g/mol, XLogP of 2.89, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hexyl-3-methoxy-2,5-dihydrofuran is sourced from PubChem (CID 11389794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).