CID 173375978

C7H9O3Te — CID 173375978

IUPAC—
SMILESCC(=O)CC(=O)C([Te])C(C)=O
InChIInChI=1S/C7H9O3Te/c1-4(8)3-6(10)7(11)5(2)9/h7H,3H2,1-2H3
InChIKeyLLQMUWFNWDUYKP-UHFFFAOYSA-N
MW268.75 g/mol
LogP0.08
Rot. Bonds4

About CID 173375978

CID 173375978 (PubChem CID 173375978) has the molecular formula C7H9O3Te and a molecular weight of 268.75 g/mol.

Molecular Properties

Compound NameCID 173375978
PubChem CID173375978
Molecular FormulaC7H9O3Te
Molecular Weight268.75 g/mol
Exact Mass270.96
IUPAC Name—
SMILESCC(=O)CC(=O)C([Te])C(C)=O
InChIInChI=1S/C7H9O3Te/c1-4(8)3-6(10)7(11)5(2)9/h7H,3H2,1-2H3
InChIKeyLLQMUWFNWDUYKP-UHFFFAOYSA-N
XLogP0.08
TPSA51.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.75
LogP ≤ 50.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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ethane;tris(pentane-2,4-dione)
CID 158826280
molybdenum(4+);tetrakis(pentane-2,4-dione)
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Frequently Asked Questions

What is the IUPAC name of CID 173375978?
The IUPAC name of CID 173375978 (CID 173375978) is not available.
What is the SMILES notation for CID 173375978?
The canonical SMILES for CID 173375978 is CC(=O)CC(=O)C([Te])C(C)=O.
What is the InChIKey of CID 173375978?
The InChIKey is LLQMUWFNWDUYKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9O3Te/c1-4(8)3-6(10)7(11)5(2)9/h7H,3H2,1-2H3.
What are the key properties of CID 173375978?
CID 173375978 has a molecular weight of 268.75 g/mol, XLogP of 0.08, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173375978 is sourced from PubChem (CID 173375978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).