5-butan-2-yloxy-1-benzotellurophene

C12H14OTe — CID 87575526

IUPAC5-butan-2-yloxy-1-benzotellurophene
SMILESCCC(C)Oc1ccc2[te]ccc2c1
InChIInChI=1S/C12H14OTe/c1-3-9(2)13-11-4-5-12-10(8-11)6-7-14-12/h4-9H,3H2,1-2H3
InChIKeyOGTRHXVFNAIZAJ-UHFFFAOYSA-N
MW301.84 g/mol
LogP3.07
Rot. Bonds3

About 5-butan-2-yloxy-1-benzotellurophene

5-butan-2-yloxy-1-benzotellurophene (PubChem CID 87575526) has the molecular formula C12H14OTe and a molecular weight of 301.84 g/mol. Its IUPAC name is 5-butan-2-yloxy-1-benzotellurophene.

Molecular Properties

Compound Name5-butan-2-yloxy-1-benzotellurophene
PubChem CID87575526
Molecular FormulaC12H14OTe
Molecular Weight301.84 g/mol
Exact Mass304.01
IUPAC Name5-butan-2-yloxy-1-benzotellurophene
SMILESCCC(C)Oc1ccc2[te]ccc2c1
InChIInChI=1S/C12H14OTe/c1-3-9(2)13-11-4-5-12-10(8-11)6-7-14-12/h4-9H,3H2,1-2H3
InChIKeyOGTRHXVFNAIZAJ-UHFFFAOYSA-N
XLogP3.07
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.84
LogP ≤ 53.07
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

7-butan-2-yloxynaphthalen-2-ol
CID 43143670
6-butan-2-yloxy-1-benzoselenophene
CID 87575596
6-butan-2-yloxynaphthalene-2-sulfonyl chloride
CID 135175462
2-bromo-4-butan-2-yloxy-1-methylbenzene
CID 127004858
1-butan-2-yloxy-4-chlorobenzene
CID 14121698
4-butan-2-yloxyaniline
CID 13097722
2-bromo-4-butan-2-yloxybenzonitrile
CID 107276996
bis[4-[(2R)-butan-2-yl]oxyphenyl]methanone
CID 131860857
lithium [2,4-di(butan-2-yloxy)phenyl]phosphanide
CID 141016038
4-butan-2-yloxybenzoic acid
CID 5132695
3-(4-butan-2-yloxy-2-methylphenyl)prop-2-yn-1-ol
CID 83134235
5-butan-2-yloxy-2-benzofuran-1,3-dione
CID 139672180

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yloxy-1-benzotellurophene?
The IUPAC name of 5-butan-2-yloxy-1-benzotellurophene (CID 87575526) is 5-butan-2-yloxy-1-benzotellurophene.
What is the SMILES notation for 5-butan-2-yloxy-1-benzotellurophene?
The canonical SMILES for 5-butan-2-yloxy-1-benzotellurophene is CCC(C)Oc1ccc2[te]ccc2c1.
What is the InChIKey of 5-butan-2-yloxy-1-benzotellurophene?
The InChIKey is OGTRHXVFNAIZAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14OTe/c1-3-9(2)13-11-4-5-12-10(8-11)6-7-14-12/h4-9H,3H2,1-2H3.
What are the key properties of 5-butan-2-yloxy-1-benzotellurophene?
5-butan-2-yloxy-1-benzotellurophene has a molecular weight of 301.84 g/mol, XLogP of 3.07, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yloxy-1-benzotellurophene is sourced from PubChem (CID 87575526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).