5-[(Z)-pent-2-enyl]oxolan-2-one

C9H14O2 — CID 6428855

IUPAC5-[(Z)-pent-2-enyl]oxolan-2-one
SMILESCC/C=C\CC1CCC(=O)O1
InChIInChI=1S/C9H14O2/c1-2-3-4-5-8-6-7-9(10)11-8/h3-4,8H,2,5-7H2,1H3/b4-3-
InChIKeyFPWNJNJVLBJJSN-ARJAWSKDSA-N
MW154.21 g/mol
LogP2.05
Rot. Bonds3

About 5-[(Z)-pent-2-enyl]oxolan-2-one

5-[(Z)-pent-2-enyl]oxolan-2-one (PubChem CID 6428855) has the molecular formula C9H14O2 and a molecular weight of 154.21 g/mol. Its IUPAC name is 5-[(Z)-pent-2-enyl]oxolan-2-one.

Molecular Properties

Compound Name5-[(Z)-pent-2-enyl]oxolan-2-one
PubChem CID6428855
Molecular FormulaC9H14O2
Molecular Weight154.21 g/mol
Exact Mass154.10
IUPAC Name5-[(Z)-pent-2-enyl]oxolan-2-one
SMILESCC/C=C\CC1CCC(=O)O1
InChIInChI=1S/C9H14O2/c1-2-3-4-5-8-6-7-9(10)11-8/h3-4,8H,2,5-7H2,1H3/b4-3-
InChIKeyFPWNJNJVLBJJSN-ARJAWSKDSA-N
XLogP2.05
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-pent-2-enyl]oxolan-2-one?
The IUPAC name of 5-[(Z)-pent-2-enyl]oxolan-2-one (CID 6428855) is 5-[(Z)-pent-2-enyl]oxolan-2-one.
What is the SMILES notation for 5-[(Z)-pent-2-enyl]oxolan-2-one?
The canonical SMILES for 5-[(Z)-pent-2-enyl]oxolan-2-one is CC/C=C\CC1CCC(=O)O1.
What is the InChIKey of 5-[(Z)-pent-2-enyl]oxolan-2-one?
The InChIKey is FPWNJNJVLBJJSN-ARJAWSKDSA-N. The full InChI is InChI=1S/C9H14O2/c1-2-3-4-5-8-6-7-9(10)11-8/h3-4,8H,2,5-7H2,1H3/b4-3-.
What are the key properties of 5-[(Z)-pent-2-enyl]oxolan-2-one?
5-[(Z)-pent-2-enyl]oxolan-2-one has a molecular weight of 154.21 g/mol, XLogP of 2.05, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-pent-2-enyl]oxolan-2-one is sourced from PubChem (CID 6428855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).