2-nona-7,8-dienoxyoxane

C14H24O2 — CID 72544316

IUPAC2-nona-7,8-dienoxyoxane
SMILESC=C=CCCCCCCOC1CCCCO1
InChIInChI=1S/C14H24O2/c1-2-3-4-5-6-7-9-12-15-14-11-8-10-13-16-14/h3,14H,1,4-13H2
InChIKeyMHOFUPZWAXHJSD-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.82
Rot. Bonds8

About 2-nona-7,8-dienoxyoxane

2-nona-7,8-dienoxyoxane (PubChem CID 72544316) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 2-nona-7,8-dienoxyoxane.

Molecular Properties

Compound Name2-nona-7,8-dienoxyoxane
PubChem CID72544316
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name2-nona-7,8-dienoxyoxane
SMILESC=C=CCCCCCCOC1CCCCO1
InChIInChI=1S/C14H24O2/c1-2-3-4-5-6-7-9-12-15-14-11-8-10-13-16-14/h3,14H,1,4-13H2
InChIKeyMHOFUPZWAXHJSD-UHFFFAOYSA-N
XLogP3.82
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-nona-7,8-dienoxyoxane?
The IUPAC name of 2-nona-7,8-dienoxyoxane (CID 72544316) is 2-nona-7,8-dienoxyoxane.
What is the SMILES notation for 2-nona-7,8-dienoxyoxane?
The canonical SMILES for 2-nona-7,8-dienoxyoxane is C=C=CCCCCCCOC1CCCCO1.
What is the InChIKey of 2-nona-7,8-dienoxyoxane?
The InChIKey is MHOFUPZWAXHJSD-UHFFFAOYSA-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/h3,14H,1,4-13H2.
What are the key properties of 2-nona-7,8-dienoxyoxane?
2-nona-7,8-dienoxyoxane has a molecular weight of 224.34 g/mol, XLogP of 3.82, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-nona-7,8-dienoxyoxane is sourced from PubChem (CID 72544316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).