2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane

C10H12O2 — CID 70580268

IUPAC2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane
SMILESC1=CC(=CCC2OCCO2)C=C1
InChIInChI=1S/C10H12O2/c1-2-4-9(3-1)5-6-10-11-7-8-12-10/h1-5,10H,6-8H2
InChIKeyGKCGTQJSJDMAPV-UHFFFAOYSA-N
MW164.20 g/mol
LogP1.80
Rot. Bonds2

About 2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane

2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane (PubChem CID 70580268) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane.

Molecular Properties

Compound Name2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane
PubChem CID70580268
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane
SMILESC1=CC(=CCC2OCCO2)C=C1
InChIInChI=1S/C10H12O2/c1-2-4-9(3-1)5-6-10-11-7-8-12-10/h1-5,10H,6-8H2
InChIKeyGKCGTQJSJDMAPV-UHFFFAOYSA-N
XLogP1.80
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane?
The IUPAC name of 2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane (CID 70580268) is 2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane.
What is the SMILES notation for 2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane?
The canonical SMILES for 2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane is C1=CC(=CCC2OCCO2)C=C1.
What is the InChIKey of 2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane?
The InChIKey is GKCGTQJSJDMAPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c1-2-4-9(3-1)5-6-10-11-7-8-12-10/h1-5,10H,6-8H2.
What are the key properties of 2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane?
2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane has a molecular weight of 164.20 g/mol, XLogP of 1.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopenta-2,4-dien-1-ylideneethyl)-1,3-dioxolane is sourced from PubChem (CID 70580268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).