2-decylfuran

C14H24O — CID 12762300

IUPAC2-decylfuran
SMILESCCCCCCCCCCc1ccco1
InChIInChI=1S/C14H24O/c1-2-3-4-5-6-7-8-9-11-14-12-10-13-15-14/h10,12-13H,2-9,11H2,1H3
InChIKeyPIBKIYYQPWSUDP-UHFFFAOYSA-N
MW208.34 g/mol
LogP4.96
Rot. Bonds9

About 2-decylfuran

2-decylfuran (PubChem CID 12762300) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is 2-decylfuran.

Molecular Properties

Compound Name2-decylfuran
PubChem CID12762300
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Name2-decylfuran
SMILESCCCCCCCCCCc1ccco1
InChIInChI=1S/C14H24O/c1-2-3-4-5-6-7-8-9-11-14-12-10-13-15-14/h10,12-13H,2-9,11H2,1H3
InChIKeyPIBKIYYQPWSUDP-UHFFFAOYSA-N
XLogP4.96
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-decylfuran?
The IUPAC name of 2-decylfuran (CID 12762300) is 2-decylfuran.
What is the SMILES notation for 2-decylfuran?
The canonical SMILES for 2-decylfuran is CCCCCCCCCCc1ccco1.
What is the InChIKey of 2-decylfuran?
The InChIKey is PIBKIYYQPWSUDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c1-2-3-4-5-6-7-8-9-11-14-12-10-13-15-14/h10,12-13H,2-9,11H2,1H3.
What are the key properties of 2-decylfuran?
2-decylfuran has a molecular weight of 208.34 g/mol, XLogP of 4.96, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-decylfuran is sourced from PubChem (CID 12762300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).