2-[(E)-pent-1-enyl]-1,3-dioxolane

C8H14O2 — CID 10356623

IUPAC2-[(E)-pent-1-enyl]-1,3-dioxolane
SMILESCCC/C=C/C1OCCO1
InChIInChI=1S/C8H14O2/c1-2-3-4-5-8-9-6-7-10-8/h4-5,8H,2-3,6-7H2,1H3/b5-4+
InChIKeyHGPHKSDKXYRGNO-SNAWJCMRSA-N
MW142.20 g/mol
LogP1.72
Rot. Bonds3

About 2-[(E)-pent-1-enyl]-1,3-dioxolane

2-[(E)-pent-1-enyl]-1,3-dioxolane (PubChem CID 10356623) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 2-[(E)-pent-1-enyl]-1,3-dioxolane.

Molecular Properties

Compound Name2-[(E)-pent-1-enyl]-1,3-dioxolane
PubChem CID10356623
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name2-[(E)-pent-1-enyl]-1,3-dioxolane
SMILESCCC/C=C/C1OCCO1
InChIInChI=1S/C8H14O2/c1-2-3-4-5-8-9-6-7-10-8/h4-5,8H,2-3,6-7H2,1H3/b5-4+
InChIKeyHGPHKSDKXYRGNO-SNAWJCMRSA-N
XLogP1.72
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.72
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 2-[(E)-pent-1-enyl]-1,3-dioxolane?
The IUPAC name of 2-[(E)-pent-1-enyl]-1,3-dioxolane (CID 10356623) is 2-[(E)-pent-1-enyl]-1,3-dioxolane.
What is the SMILES notation for 2-[(E)-pent-1-enyl]-1,3-dioxolane?
The canonical SMILES for 2-[(E)-pent-1-enyl]-1,3-dioxolane is CCC/C=C/C1OCCO1.
What is the InChIKey of 2-[(E)-pent-1-enyl]-1,3-dioxolane?
The InChIKey is HGPHKSDKXYRGNO-SNAWJCMRSA-N. The full InChI is InChI=1S/C8H14O2/c1-2-3-4-5-8-9-6-7-10-8/h4-5,8H,2-3,6-7H2,1H3/b5-4+.
What are the key properties of 2-[(E)-pent-1-enyl]-1,3-dioxolane?
2-[(E)-pent-1-enyl]-1,3-dioxolane has a molecular weight of 142.20 g/mol, XLogP of 1.72, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-pent-1-enyl]-1,3-dioxolane is sourced from PubChem (CID 10356623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).