CID 12607295

C7H7OTe — CID 12607295

IUPAC—
SMILESCOc1ccc([Te])cc1
InChIInChI=1S/C7H7OTe/c1-8-6-2-4-7(9)5-3-6/h2-5H,1H3
InChIKeyVYSSJOSJFKXLPU-UHFFFAOYSA-N
MW234.73 g/mol
LogP0.49
Rot. Bonds1

About CID 12607295

CID 12607295 (PubChem CID 12607295) has the molecular formula C7H7OTe and a molecular weight of 234.73 g/mol.

Molecular Properties

Compound NameCID 12607295
PubChem CID12607295
Molecular FormulaC7H7OTe
Molecular Weight234.73 g/mol
Exact Mass236.96
IUPAC Name—
SMILESCOc1ccc([Te])cc1
InChIInChI=1S/C7H7OTe/c1-8-6-2-4-7(9)5-3-6/h2-5H,1H3
InChIKeyVYSSJOSJFKXLPU-UHFFFAOYSA-N
XLogP0.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.73
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,4-dimethoxybenzene;molecular nitrogen;hydrochloride
CID 173452430
1-(113C)methoxy-4-methylbenzene
CID 166176950
(4-methoxyanilino) thiohypofluorite
CID 175225532
4-methoxy-N-methylsulfanylaniline
CID 123820193
(4-methoxyphenyl) nitrite
CID 118559618
1-methoxy-4-[2-(4-methoxyanilino)hydrazinyl]benzene
CID 163682432
N,4-dimethoxyaniline
CID 23340556
(4-methoxyphenyl)silane
CID 100998160
CID 154175564
CID 154175564
4-methoxyaniline;hydrobromide
CID 518270
1,3-dimethoxybenzene;1,4-dimethoxybenzene
CID 91359455
methane;4-methoxyphenol
CID 159494332

Frequently Asked Questions

What is the IUPAC name of CID 12607295?
The IUPAC name of CID 12607295 (CID 12607295) is not available.
What is the SMILES notation for CID 12607295?
The canonical SMILES for CID 12607295 is COc1ccc([Te])cc1.
What is the InChIKey of CID 12607295?
The InChIKey is VYSSJOSJFKXLPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7OTe/c1-8-6-2-4-7(9)5-3-6/h2-5H,1H3.
What are the key properties of CID 12607295?
CID 12607295 has a molecular weight of 234.73 g/mol, XLogP of 0.49, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 12607295 is sourced from PubChem (CID 12607295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).