4-cyclohexylfuran-2-carbaldehyde;ethane

C13H20O2 — CID 142856925

IUPAC4-cyclohexylfuran-2-carbaldehyde;ethane
SMILESCC.O=Cc1cc(C2CCCCC2)co1
InChIInChI=1S/C11H14O2.C2H6/c12-7-11-6-10(8-13-11)9-4-2-1-3-5-9;1-2/h6-9H,1-5H2;1-2H3
InChIKeyWODLIVPAHSADTF-UHFFFAOYSA-N
MW208.30 g/mol
LogP4.17
Rot. Bonds2

About 4-cyclohexylfuran-2-carbaldehyde;ethane

4-cyclohexylfuran-2-carbaldehyde;ethane (PubChem CID 142856925) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 4-cyclohexylfuran-2-carbaldehyde;ethane.

Molecular Properties

Compound Name4-cyclohexylfuran-2-carbaldehyde;ethane
PubChem CID142856925
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name4-cyclohexylfuran-2-carbaldehyde;ethane
SMILESCC.O=Cc1cc(C2CCCCC2)co1
InChIInChI=1S/C11H14O2.C2H6/c12-7-11-6-10(8-13-11)9-4-2-1-3-5-9;1-2/h6-9H,1-5H2;1-2H3
InChIKeyWODLIVPAHSADTF-UHFFFAOYSA-N
XLogP4.17
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-4-cyclohexylfuran
CID 174977768
4-(cyclopentanecarbonyl)furan-2-carbaldehyde
CID 84719861
4-cycloheptylbenzaldehyde
CID 21484445
4-cyclooctylbenzaldehyde
CID 12923818
1,3,5-tricyclopentylbenzene
CID 611596
5-cyclohexylpyridine-3-carbaldehyde
CID 82404419
4-bromo-5-cyclopentylfuran-2-carbaldehyde
CID 83843424
5-cyclohexyl-3-methylfuran-2-carbaldehyde
CID 19430344
(4S)-4-[5-[(Z)-2-carboxyprop-1-enyl]furan-3-yl]cyclohexene-1-carboxylic acid
CID 169491480
4-cyclohexyl-1,3-oxazole-5-carbaldehyde
CID 83816829
4-cyclopentyl-1,2-oxazole;ethane
CID 142450092
5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde
CID 165451234

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexylfuran-2-carbaldehyde;ethane?
The IUPAC name of 4-cyclohexylfuran-2-carbaldehyde;ethane (CID 142856925) is 4-cyclohexylfuran-2-carbaldehyde;ethane.
What is the SMILES notation for 4-cyclohexylfuran-2-carbaldehyde;ethane?
The canonical SMILES for 4-cyclohexylfuran-2-carbaldehyde;ethane is CC.O=Cc1cc(C2CCCCC2)co1.
What is the InChIKey of 4-cyclohexylfuran-2-carbaldehyde;ethane?
The InChIKey is WODLIVPAHSADTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2.C2H6/c12-7-11-6-10(8-13-11)9-4-2-1-3-5-9;1-2/h6-9H,1-5H2;1-2H3.
What are the key properties of 4-cyclohexylfuran-2-carbaldehyde;ethane?
4-cyclohexylfuran-2-carbaldehyde;ethane has a molecular weight of 208.30 g/mol, XLogP of 4.17, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexylfuran-2-carbaldehyde;ethane is sourced from PubChem (CID 142856925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).