1-(2-ethenoxyethoxy)dodecane

C16H32O2 — CID 59950400

IUPAC1-(2-ethenoxyethoxy)dodecane
SMILESC=COCCOCCCCCCCCCCCC
InChIInChI=1S/C16H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-18-16-15-17-4-2/h4H,2-3,5-16H2,1H3
InChIKeyHPHFVMVXMRNNOY-UHFFFAOYSA-N
MW256.43 g/mol
LogP5.08
Rot. Bonds15

About 1-(2-ethenoxyethoxy)dodecane

1-(2-ethenoxyethoxy)dodecane (PubChem CID 59950400) has the molecular formula C16H32O2 and a molecular weight of 256.43 g/mol. Its IUPAC name is 1-(2-ethenoxyethoxy)dodecane.

Molecular Properties

Compound Name1-(2-ethenoxyethoxy)dodecane
PubChem CID59950400
Molecular FormulaC16H32O2
Molecular Weight256.43 g/mol
Exact Mass256.24
IUPAC Name1-(2-ethenoxyethoxy)dodecane
SMILESC=COCCOCCCCCCCCCCCC
InChIInChI=1S/C16H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-18-16-15-17-4-2/h4H,2-3,5-16H2,1H3
InChIKeyHPHFVMVXMRNNOY-UHFFFAOYSA-N
XLogP5.08
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.43
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane
CID 151662960
1-ethenoxytriacontane
CID 14647805
1-(2-decoxyethoxy)decane
CID 14009354
1-[2-[2-[2-[2-(2-pentoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]heptane
CID 150797704
1-[2-(2-tetradecoxyethoxy)ethoxy]tetradecane
CID 10743953
1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hexadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octadecane
CID 86345710
1-(2-octoxyethoxy)octane
CID 12711862
1-[2-[2-[2-[2-[2-(2-hexoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octane
CID 151767279
1-[2-(2-heptoxyethoxy)ethoxy]heptane
CID 14402381
1-[2-[2-[2-(2-hexoxyethoxy)ethoxy]ethoxy]ethoxy]octane
CID 86197097
1-(2-nonoxyethoxy)nonane
CID 87982931
buta-1,3-diene;1-pentoxypentane
CID 87924219

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethenoxyethoxy)dodecane?
The IUPAC name of 1-(2-ethenoxyethoxy)dodecane (CID 59950400) is 1-(2-ethenoxyethoxy)dodecane.
What is the SMILES notation for 1-(2-ethenoxyethoxy)dodecane?
The canonical SMILES for 1-(2-ethenoxyethoxy)dodecane is C=COCCOCCCCCCCCCCCC.
What is the InChIKey of 1-(2-ethenoxyethoxy)dodecane?
The InChIKey is HPHFVMVXMRNNOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-18-16-15-17-4-2/h4H,2-3,5-16H2,1H3.
What are the key properties of 1-(2-ethenoxyethoxy)dodecane?
1-(2-ethenoxyethoxy)dodecane has a molecular weight of 256.43 g/mol, XLogP of 5.08, 15 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethenoxyethoxy)dodecane is sourced from PubChem (CID 59950400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).