[(E)-2-ethylhex-1-enoxy]cyclohexane

C14H26O — CID 67938935

IUPAC[(E)-2-ethylhex-1-enoxy]cyclohexane
SMILESCCCC/C(=C/OC1CCCCC1)CC
InChIInChI=1S/C14H26O/c1-3-5-9-13(4-2)12-15-14-10-7-6-8-11-14/h12,14H,3-11H2,1-2H3/b13-12+
InChIKeyVWWUQVLEWNLSJQ-OUKQBFOZSA-N
MW210.36 g/mol
LogP4.82
Rot. Bonds6

About [(E)-2-ethylhex-1-enoxy]cyclohexane

[(E)-2-ethylhex-1-enoxy]cyclohexane (PubChem CID 67938935) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is [(E)-2-ethylhex-1-enoxy]cyclohexane.

Molecular Properties

Compound Name[(E)-2-ethylhex-1-enoxy]cyclohexane
PubChem CID67938935
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name[(E)-2-ethylhex-1-enoxy]cyclohexane
SMILESCCCC/C(=C/OC1CCCCC1)CC
InChIInChI=1S/C14H26O/c1-3-5-9-13(4-2)12-15-14-10-7-6-8-11-14/h12,14H,3-11H2,1-2H3/b13-12+
InChIKeyVWWUQVLEWNLSJQ-OUKQBFOZSA-N
XLogP4.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(E)-2-ethylhex-1-enoxy]cyclohexane?
The IUPAC name of [(E)-2-ethylhex-1-enoxy]cyclohexane (CID 67938935) is [(E)-2-ethylhex-1-enoxy]cyclohexane.
What is the SMILES notation for [(E)-2-ethylhex-1-enoxy]cyclohexane?
The canonical SMILES for [(E)-2-ethylhex-1-enoxy]cyclohexane is CCCC/C(=C/OC1CCCCC1)CC.
What is the InChIKey of [(E)-2-ethylhex-1-enoxy]cyclohexane?
The InChIKey is VWWUQVLEWNLSJQ-OUKQBFOZSA-N. The full InChI is InChI=1S/C14H26O/c1-3-5-9-13(4-2)12-15-14-10-7-6-8-11-14/h12,14H,3-11H2,1-2H3/b13-12+.
What are the key properties of [(E)-2-ethylhex-1-enoxy]cyclohexane?
[(E)-2-ethylhex-1-enoxy]cyclohexane has a molecular weight of 210.36 g/mol, XLogP of 4.82, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-ethylhex-1-enoxy]cyclohexane is sourced from PubChem (CID 67938935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).