2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane

C12H12O2 — CID 13097480

IUPAC2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane
SMILESC1=C\C=C/C(=C2OCCO2)/C=C\C=C/1
InChIInChI=1S/C12H12O2/c1-2-4-6-8-11(7-5-3-1)12-13-9-10-14-12/h1-8H,9-10H2/b3-1-,4-2-,7-5-,8-6-
InChIKeyYWRMCRZOKVLOJW-KZPCVFJPSA-N
MW188.23 g/mol
LogP2.48
Rot. Bonds

About 2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane

2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane (PubChem CID 13097480) has the molecular formula C12H12O2 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane.

Molecular Properties

Compound Name2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane
PubChem CID13097480
Molecular FormulaC12H12O2
Molecular Weight188.23 g/mol
Exact Mass188.08
IUPAC Name2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane
SMILESC1=C\C=C/C(=C2OCCO2)/C=C\C=C/1
InChIInChI=1S/C12H12O2/c1-2-4-6-8-11(7-5-3-1)12-13-9-10-14-12/h1-8H,9-10H2/b3-1-,4-2-,7-5-,8-6-
InChIKeyYWRMCRZOKVLOJW-KZPCVFJPSA-N
XLogP2.48
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane?
The IUPAC name of 2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane (CID 13097480) is 2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane.
What is the SMILES notation for 2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane?
The canonical SMILES for 2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane is C1=C\C=C/C(=C2OCCO2)/C=C\C=C/1.
What is the InChIKey of 2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane?
The InChIKey is YWRMCRZOKVLOJW-KZPCVFJPSA-N. The full InChI is InChI=1S/C12H12O2/c1-2-4-6-8-11(7-5-3-1)12-13-9-10-14-12/h1-8H,9-10H2/b3-1-,4-2-,7-5-,8-6-.
What are the key properties of 2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane?
2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane has a molecular weight of 188.23 g/mol, XLogP of 2.48, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-1,3-dioxolane is sourced from PubChem (CID 13097480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).