(Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene

C14H26O2 — CID 5367767

IUPAC(Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene
SMILESCC/C=C\CCOC(C)OCC/C=C\CC
InChIInChI=1S/C14H26O2/c1-4-6-8-10-12-15-14(3)16-13-11-9-7-5-2/h6-9,14H,4-5,10-13H2,1-3H3/b8-6-,9-7-
InChIKeyKCPFRJBAXWUXIG-VRHVFUOLSA-N
MW226.36 g/mol
LogP4.08
Rot. Bonds10

About (Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene

(Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene (PubChem CID 5367767) has the molecular formula C14H26O2 and a molecular weight of 226.36 g/mol. Its IUPAC name is (Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene.

Molecular Properties

Compound Name(Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene
PubChem CID5367767
Molecular FormulaC14H26O2
Molecular Weight226.36 g/mol
Exact Mass226.19
IUPAC Name(Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene
SMILESCC/C=C\CCOC(C)OCC/C=C\CC
InChIInChI=1S/C14H26O2/c1-4-6-8-10-12-15-14(3)16-13-11-9-7-5-2/h6-9,14H,4-5,10-13H2,1-3H3/b8-6-,9-7-
InChIKeyKCPFRJBAXWUXIG-VRHVFUOLSA-N
XLogP4.08
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 (Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene?
The IUPAC name of (Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene (CID 5367767) is (Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene.
What is the SMILES notation for (Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene?
The canonical SMILES for (Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene is CC/C=C\CCOC(C)OCC/C=C\CC.
What is the InChIKey of (Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene?
The InChIKey is KCPFRJBAXWUXIG-VRHVFUOLSA-N. The full InChI is InChI=1S/C14H26O2/c1-4-6-8-10-12-15-14(3)16-13-11-9-7-5-2/h6-9,14H,4-5,10-13H2,1-3H3/b8-6-,9-7-.
What are the key properties of (Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene?
(Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene has a molecular weight of 226.36 g/mol, XLogP of 4.08, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene is sourced from PubChem (CID 5367767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).