11-(2-methoxyethoxy)undec-1-ene

C14H28O2 — CID 142718624

IUPAC11-(2-methoxyethoxy)undec-1-ene
SMILESC=CCCCCCCCCCOCCOC
InChIInChI=1S/C14H28O2/c1-3-4-5-6-7-8-9-10-11-12-16-14-13-15-2/h3H,1,4-14H2,2H3
InChIKeyDPQBTOUHXQZKSR-UHFFFAOYSA-N
MW228.38 g/mol
LogP3.96
Rot. Bonds13

About 11-(2-methoxyethoxy)undec-1-ene

11-(2-methoxyethoxy)undec-1-ene (PubChem CID 142718624) has the molecular formula C14H28O2 and a molecular weight of 228.38 g/mol. Its IUPAC name is 11-(2-methoxyethoxy)undec-1-ene.

Molecular Properties

Compound Name11-(2-methoxyethoxy)undec-1-ene
PubChem CID142718624
Molecular FormulaC14H28O2
Molecular Weight228.38 g/mol
Exact Mass228.21
IUPAC Name11-(2-methoxyethoxy)undec-1-ene
SMILESC=CCCCCCCCCCOCCOC
InChIInChI=1S/C14H28O2/c1-3-4-5-6-7-8-9-10-11-12-16-14-13-15-2/h3H,1,4-14H2,2H3
InChIKeyDPQBTOUHXQZKSR-UHFFFAOYSA-N
XLogP3.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 11-(2-methoxyethoxy)undec-1-ene?
The IUPAC name of 11-(2-methoxyethoxy)undec-1-ene (CID 142718624) is 11-(2-methoxyethoxy)undec-1-ene.
What is the SMILES notation for 11-(2-methoxyethoxy)undec-1-ene?
The canonical SMILES for 11-(2-methoxyethoxy)undec-1-ene is C=CCCCCCCCCCOCCOC.
What is the InChIKey of 11-(2-methoxyethoxy)undec-1-ene?
The InChIKey is DPQBTOUHXQZKSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2/c1-3-4-5-6-7-8-9-10-11-12-16-14-13-15-2/h3H,1,4-14H2,2H3.
What are the key properties of 11-(2-methoxyethoxy)undec-1-ene?
11-(2-methoxyethoxy)undec-1-ene has a molecular weight of 228.38 g/mol, XLogP of 3.96, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(2-methoxyethoxy)undec-1-ene is sourced from PubChem (CID 142718624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).