2-[(3Z,5E)-nona-3,5-dienoxy]oxane

C14H24O2 — CID 177457132

IUPAC2-[(3Z,5E)-nona-3,5-dienoxy]oxane
SMILESCCC/C=C/C=C\CCOC1CCCCO1
InChIInChI=1S/C14H24O2/c1-2-3-4-5-6-7-9-12-15-14-11-8-10-13-16-14/h4-7,14H,2-3,8-13H2,1H3/b5-4+,7-6-
InChIKeyHTYKDHQWJKSTON-DEQVHDEQSA-N
MW224.34 g/mol
LogP3.83
Rot. Bonds7

About 2-[(3Z,5E)-nona-3,5-dienoxy]oxane

2-[(3Z,5E)-nona-3,5-dienoxy]oxane (PubChem CID 177457132) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 2-[(3Z,5E)-nona-3,5-dienoxy]oxane.

Molecular Properties

Compound Name2-[(3Z,5E)-nona-3,5-dienoxy]oxane
PubChem CID177457132
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name2-[(3Z,5E)-nona-3,5-dienoxy]oxane
SMILESCCC/C=C/C=C\CCOC1CCCCO1
InChIInChI=1S/C14H24O2/c1-2-3-4-5-6-7-9-12-15-14-11-8-10-13-16-14/h4-7,14H,2-3,8-13H2,1H3/b5-4+,7-6-
InChIKeyHTYKDHQWJKSTON-DEQVHDEQSA-N
XLogP3.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-hept-3-enoxyoxetane
CID 54540025
(2S)-2-[(5Z,9Z)-trideca-5,9-dienoxy]oxane
CID 125486039
2-[(E)-dec-3-enoxy]oxane
CID 15649194
2-[(Z)-4-iodobut-3-enoxy]oxane
CID 10423866
(2R)-2-[(Z)-tridec-9-en-5-ynoxy]oxane
CID 125486244
8-(oxan-2-yloxy)oct-5-en-4-ol
CID 71414268
(2R)-2-[(E)-dodec-5-enoxy]oxane
CID 125486255
2-[(6Z,12Z)-octadeca-6,12-dienoxy]oxane
CID 163386037
(2R)-2-[(8E,10E)-dodeca-8,10-dienoxy]oxane
CID 6450274
2-octacosoxyoxane
CID 11214102
ethyl (E)-5-(oxan-2-yloxy)pent-2-enoate
CID 15839787
7-(oxan-2-yloxy)hept-2-enal
CID 54196488

Frequently Asked Questions

What is the IUPAC name of 2-[(3Z,5E)-nona-3,5-dienoxy]oxane?
The IUPAC name of 2-[(3Z,5E)-nona-3,5-dienoxy]oxane (CID 177457132) is 2-[(3Z,5E)-nona-3,5-dienoxy]oxane.
What is the SMILES notation for 2-[(3Z,5E)-nona-3,5-dienoxy]oxane?
The canonical SMILES for 2-[(3Z,5E)-nona-3,5-dienoxy]oxane is CCC/C=C/C=C\CCOC1CCCCO1.
What is the InChIKey of 2-[(3Z,5E)-nona-3,5-dienoxy]oxane?
The InChIKey is HTYKDHQWJKSTON-DEQVHDEQSA-N. The full InChI is InChI=1S/C14H24O2/c1-2-3-4-5-6-7-9-12-15-14-11-8-10-13-16-14/h4-7,14H,2-3,8-13H2,1H3/b5-4+,7-6-.
What are the key properties of 2-[(3Z,5E)-nona-3,5-dienoxy]oxane?
2-[(3Z,5E)-nona-3,5-dienoxy]oxane has a molecular weight of 224.34 g/mol, XLogP of 3.83, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3Z,5E)-nona-3,5-dienoxy]oxane is sourced from PubChem (CID 177457132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).