CID 134890786

C8H10NO2Te — CID 134890786

IUPAC—
SMILESCOc1cc(N)c([Te])cc1OC
InChIInChI=1S/C8H10NO2Te/c1-10-6-3-5(9)8(12)4-7(6)11-2/h3-4H,9H2,1-2H3
InChIKeyCDOTVRXBLLMVSO-UHFFFAOYSA-N
MW279.77 g/mol
LogP0.08
Rot. Bonds2

About CID 134890786

CID 134890786 (PubChem CID 134890786) has the molecular formula C8H10NO2Te and a molecular weight of 279.77 g/mol.

Molecular Properties

Compound NameCID 134890786
PubChem CID134890786
Molecular FormulaC8H10NO2Te
Molecular Weight279.77 g/mol
Exact Mass281.98
IUPAC Name—
SMILESCOc1cc(N)c([Te])cc1OC
InChIInChI=1S/C8H10NO2Te/c1-10-6-3-5(9)8(12)4-7(6)11-2/h3-4H,9H2,1-2H3
InChIKeyCDOTVRXBLLMVSO-UHFFFAOYSA-N
XLogP0.08
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.77
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 134890786?
The IUPAC name of CID 134890786 (CID 134890786) is not available.
What is the SMILES notation for CID 134890786?
The canonical SMILES for CID 134890786 is COc1cc(N)c([Te])cc1OC.
What is the InChIKey of CID 134890786?
The InChIKey is CDOTVRXBLLMVSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10NO2Te/c1-10-6-3-5(9)8(12)4-7(6)11-2/h3-4H,9H2,1-2H3.
What are the key properties of CID 134890786?
CID 134890786 has a molecular weight of 279.77 g/mol, XLogP of 0.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134890786 is sourced from PubChem (CID 134890786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).