hydron;methyl 2-tellanylpropanoate

C4H9O2Te+ — CID 174889202

IUPAChydron;methyl 2-tellanylpropanoate
SMILESCOC(=O)C(C)[TeH].[H+]
InChIInChI=1S/C4H8O2Te/c1-3(7)4(5)6-2/h3,7H,1-2H3/p+1
InChIKeyOCPNBBJSUWQADT-UHFFFAOYSA-O
MW216.71 g/mol
LogP-0.02
Rot. Bonds1

About hydron;methyl 2-tellanylpropanoate

hydron;methyl 2-tellanylpropanoate (PubChem CID 174889202) has the molecular formula C4H9O2Te+ and a molecular weight of 216.71 g/mol. Its IUPAC name is hydron;methyl 2-tellanylpropanoate.

Molecular Properties

Compound Namehydron;methyl 2-tellanylpropanoate
PubChem CID174889202
Molecular FormulaC4H9O2Te+
Molecular Weight216.71 g/mol
Exact Mass218.97
IUPAC Namehydron;methyl 2-tellanylpropanoate
SMILESCOC(=O)C(C)[TeH].[H+]
InChIInChI=1S/C4H8O2Te/c1-3(7)4(5)6-2/h3,7H,1-2H3/p+1
InChIKeyOCPNBBJSUWQADT-UHFFFAOYSA-O
XLogP-0.02
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.71
LogP ≤ 5-0.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hydron;methyl 2-tellanylpropanoate?
The IUPAC name of hydron;methyl 2-tellanylpropanoate (CID 174889202) is hydron;methyl 2-tellanylpropanoate.
What is the SMILES notation for hydron;methyl 2-tellanylpropanoate?
The canonical SMILES for hydron;methyl 2-tellanylpropanoate is COC(=O)C(C)[TeH].[H+].
What is the InChIKey of hydron;methyl 2-tellanylpropanoate?
The InChIKey is OCPNBBJSUWQADT-UHFFFAOYSA-O. The full InChI is InChI=1S/C4H8O2Te/c1-3(7)4(5)6-2/h3,7H,1-2H3/p+1.
What are the key properties of hydron;methyl 2-tellanylpropanoate?
hydron;methyl 2-tellanylpropanoate has a molecular weight of 216.71 g/mol, XLogP of -0.02, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;methyl 2-tellanylpropanoate is sourced from PubChem (CID 174889202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).