4-ethyl-3,3,5-trimethyl-2H-furan

C9H16O — CID 89488994

IUPAC4-ethyl-3,3,5-trimethyl-2H-furan
SMILESCCC1=C(C)OCC1(C)C
InChIInChI=1S/C9H16O/c1-5-8-7(2)10-6-9(8,3)4/h5-6H2,1-4H3
InChIKeyOQGOUVXCPPGMEG-UHFFFAOYSA-N
MW140.23 g/mol
LogP2.73
Rot. Bonds1

About 4-ethyl-3,3,5-trimethyl-2H-furan

4-ethyl-3,3,5-trimethyl-2H-furan (PubChem CID 89488994) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is 4-ethyl-3,3,5-trimethyl-2H-furan.

Molecular Properties

Compound Name4-ethyl-3,3,5-trimethyl-2H-furan
PubChem CID89488994
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name4-ethyl-3,3,5-trimethyl-2H-furan
SMILESCCC1=C(C)OCC1(C)C
InChIInChI=1S/C9H16O/c1-5-8-7(2)10-6-9(8,3)4/h5-6H2,1-4H3
InChIKeyOQGOUVXCPPGMEG-UHFFFAOYSA-N
XLogP2.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(Z)-2-fluoro-4,4-dimethyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]pent-2-ene
CID 89397950
2-fluoro-3,3,4,5-tetramethyl-2H-furan
CID 123896136
4,5-Ditert-butyl-2-propyl-2,3-dihydrofuran
CID 20773255
4,5-Di(propan-2-yl)-2,3-dihydrofuran
CID 22965809
4,5-Ditert-butyl-2-methyl-2,3-dihydrofuran
CID 23592138
4,5-ditert-butyl-3H-furan-2-thione
CID 57531846
4,5-Ditert-butyl-2,3-dihydrofuran
CID 57531847
4,5-ditert-butyl-2,2-dimethyl-3H-furan
CID 57908149
3,3-dimethyl-4,5-di(propan-2-yl)-2H-furan
CID 58201807
4,5-ditert-butyl-3,3-dimethyl-2H-furan
CID 59129232
4-Tert-butyl-5-propan-2-yl-2,3-dihydrofuran
CID 59506689
3,5-Ditert-butyl-4-propan-2-yl-2,3-dihydrofuran
CID 59616734

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3,3,5-trimethyl-2H-furan?
The IUPAC name of 4-ethyl-3,3,5-trimethyl-2H-furan (CID 89488994) is 4-ethyl-3,3,5-trimethyl-2H-furan.
What is the SMILES notation for 4-ethyl-3,3,5-trimethyl-2H-furan?
The canonical SMILES for 4-ethyl-3,3,5-trimethyl-2H-furan is CCC1=C(C)OCC1(C)C.
What is the InChIKey of 4-ethyl-3,3,5-trimethyl-2H-furan?
The InChIKey is OQGOUVXCPPGMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O/c1-5-8-7(2)10-6-9(8,3)4/h5-6H2,1-4H3.
What are the key properties of 4-ethyl-3,3,5-trimethyl-2H-furan?
4-ethyl-3,3,5-trimethyl-2H-furan has a molecular weight of 140.23 g/mol, XLogP of 2.73, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3,3,5-trimethyl-2H-furan is sourced from PubChem (CID 89488994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).