2-(1,3-ditellurol-2-ylidene)propanedial

C6H4O2Te2 — CID 12964891

IUPAC2-(1,3-ditellurol-2-ylidene)propanedial
SMILESO=CC(C=O)=C1[Te]C=C[Te]1
InChIInChI=1S/C6H4O2Te2/c7-3-5(4-8)6-9-1-2-10-6/h1-4H
InChIKeyARPGFNHLCZETHH-UHFFFAOYSA-N
MW363.30 g/mol
LogP-0.51
Rot. Bonds2

About 2-(1,3-ditellurol-2-ylidene)propanedial

2-(1,3-ditellurol-2-ylidene)propanedial (PubChem CID 12964891) has the molecular formula C6H4O2Te2 and a molecular weight of 363.30 g/mol. Its IUPAC name is 2-(1,3-ditellurol-2-ylidene)propanedial.

Molecular Properties

Compound Name2-(1,3-ditellurol-2-ylidene)propanedial
PubChem CID12964891
Molecular FormulaC6H4O2Te2
Molecular Weight363.30 g/mol
Exact Mass367.83
IUPAC Name2-(1,3-ditellurol-2-ylidene)propanedial
SMILESO=CC(C=O)=C1[Te]C=C[Te]1
InChIInChI=1S/C6H4O2Te2/c7-3-5(4-8)6-9-1-2-10-6/h1-4H
InChIKeyARPGFNHLCZETHH-UHFFFAOYSA-N
XLogP-0.51
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.30
LogP ≤ 5-0.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_4', 'substructure': 'N/A'}

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Related Compounds

Alltrial
CID 57005079
2-(1,3-Diselenol-2-ylidene)propanedial
CID 11065363

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-ditellurol-2-ylidene)propanedial?
The IUPAC name of 2-(1,3-ditellurol-2-ylidene)propanedial (CID 12964891) is 2-(1,3-ditellurol-2-ylidene)propanedial.
What is the SMILES notation for 2-(1,3-ditellurol-2-ylidene)propanedial?
The canonical SMILES for 2-(1,3-ditellurol-2-ylidene)propanedial is O=CC(C=O)=C1[Te]C=C[Te]1.
What is the InChIKey of 2-(1,3-ditellurol-2-ylidene)propanedial?
The InChIKey is ARPGFNHLCZETHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4O2Te2/c7-3-5(4-8)6-9-1-2-10-6/h1-4H.
What are the key properties of 2-(1,3-ditellurol-2-ylidene)propanedial?
2-(1,3-ditellurol-2-ylidene)propanedial has a molecular weight of 363.30 g/mol, XLogP of -0.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-ditellurol-2-ylidene)propanedial is sourced from PubChem (CID 12964891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).