6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene

C14H24O3 — CID 172760898

IUPAC6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene
SMILESC=COCCOC(C)OC1CCCC=C1CC
InChIInChI=1S/C14H24O3/c1-4-13-8-6-7-9-14(13)17-12(3)16-11-10-15-5-2/h5,8,12,14H,2,4,6-7,9-11H2,1,3H3
InChIKeyLRABNLWDMWBZSB-UHFFFAOYSA-N
MW240.34 g/mol
LogP3.41
Rot. Bonds8

About 6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene

6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene (PubChem CID 172760898) has the molecular formula C14H24O3 and a molecular weight of 240.34 g/mol. Its IUPAC name is 6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene.

Molecular Properties

Compound Name6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene
PubChem CID172760898
Molecular FormulaC14H24O3
Molecular Weight240.34 g/mol
Exact Mass240.17
IUPAC Name6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene
SMILESC=COCCOC(C)OC1CCCC=C1CC
InChIInChI=1S/C14H24O3/c1-4-13-8-6-7-9-14(13)17-12(3)16-11-10-15-5-2/h5,8,12,14H,2,4,6-7,9-11H2,1,3H3
InChIKeyLRABNLWDMWBZSB-UHFFFAOYSA-N
XLogP3.41
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.34
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene?
The IUPAC name of 6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene (CID 172760898) is 6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene.
What is the SMILES notation for 6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene?
The canonical SMILES for 6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene is C=COCCOC(C)OC1CCCC=C1CC.
What is the InChIKey of 6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene?
The InChIKey is LRABNLWDMWBZSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O3/c1-4-13-8-6-7-9-14(13)17-12(3)16-11-10-15-5-2/h5,8,12,14H,2,4,6-7,9-11H2,1,3H3.
What are the key properties of 6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene?
6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene has a molecular weight of 240.34 g/mol, XLogP of 3.41, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(2-ethenoxyethoxy)ethoxy]-1-ethylcyclohexene is sourced from PubChem (CID 172760898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).