(2R)-2-[(2Z)-penta-2,4-dienyl]oxolane

C9H14O — CID 89312537

IUPAC(2R)-2-[(2Z)-penta-2,4-dienyl]oxolane
SMILESC=C/C=C\C[C@H]1CCCO1
InChIInChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h2-4,9H,1,5-8H2/b4-3-/t9-/m0/s1
InChIKeyOFJYHXLCNPCYOA-TYRPZCRBSA-N
MW138.21 g/mol
LogP2.30
Rot. Bonds3

About (2R)-2-[(2Z)-penta-2,4-dienyl]oxolane

(2R)-2-[(2Z)-penta-2,4-dienyl]oxolane (PubChem CID 89312537) has the molecular formula C9H14O and a molecular weight of 138.21 g/mol. Its IUPAC name is (2R)-2-[(2Z)-penta-2,4-dienyl]oxolane.

Molecular Properties

Compound Name(2R)-2-[(2Z)-penta-2,4-dienyl]oxolane
PubChem CID89312537
Molecular FormulaC9H14O
Molecular Weight138.21 g/mol
Exact Mass138.10
IUPAC Name(2R)-2-[(2Z)-penta-2,4-dienyl]oxolane
SMILESC=C/C=C\C[C@H]1CCCO1
InChIInChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h2-4,9H,1,5-8H2/b4-3-/t9-/m0/s1
InChIKeyOFJYHXLCNPCYOA-TYRPZCRBSA-N
XLogP2.30
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2Z)-penta-2,4-dienyl]oxolane?
The IUPAC name of (2R)-2-[(2Z)-penta-2,4-dienyl]oxolane (CID 89312537) is (2R)-2-[(2Z)-penta-2,4-dienyl]oxolane.
What is the SMILES notation for (2R)-2-[(2Z)-penta-2,4-dienyl]oxolane?
The canonical SMILES for (2R)-2-[(2Z)-penta-2,4-dienyl]oxolane is C=C/C=C\C[C@H]1CCCO1.
What is the InChIKey of (2R)-2-[(2Z)-penta-2,4-dienyl]oxolane?
The InChIKey is OFJYHXLCNPCYOA-TYRPZCRBSA-N. The full InChI is InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h2-4,9H,1,5-8H2/b4-3-/t9-/m0/s1.
What are the key properties of (2R)-2-[(2Z)-penta-2,4-dienyl]oxolane?
(2R)-2-[(2Z)-penta-2,4-dienyl]oxolane has a molecular weight of 138.21 g/mol, XLogP of 2.30, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2Z)-penta-2,4-dienyl]oxolane is sourced from PubChem (CID 89312537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).