2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane

C14H22O2Te — CID 139265703

IUPAC2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane
SMILESC#C/C=C(/COC1CCCCO1)[Te]CCCC
InChIInChI=1S/C14H22O2Te/c1-3-5-11-17-13(8-4-2)12-16-14-9-6-7-10-15-14/h2,8,14H,3,5-7,9-12H2,1H3/b13-8-
InChIKeyVLKAVAGQCGIDKM-JYRVWZFOSA-N
MW349.93 g/mol
LogP2.97
Rot. Bonds7

About 2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane

2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane (PubChem CID 139265703) has the molecular formula C14H22O2Te and a molecular weight of 349.93 g/mol. Its IUPAC name is 2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane.

Molecular Properties

Compound Name2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane
PubChem CID139265703
Molecular FormulaC14H22O2Te
Molecular Weight349.93 g/mol
Exact Mass352.07
IUPAC Name2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane
SMILESC#C/C=C(/COC1CCCCO1)[Te]CCCC
InChIInChI=1S/C14H22O2Te/c1-3-5-11-17-13(8-4-2)12-16-14-9-6-7-10-15-14/h2,8,14H,3,5-7,9-12H2,1H3/b13-8-
InChIKeyVLKAVAGQCGIDKM-JYRVWZFOSA-N
XLogP2.97
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.93
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane?
The IUPAC name of 2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane (CID 139265703) is 2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane.
What is the SMILES notation for 2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane?
The canonical SMILES for 2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane is C#C/C=C(/COC1CCCCO1)[Te]CCCC.
What is the InChIKey of 2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane?
The InChIKey is VLKAVAGQCGIDKM-JYRVWZFOSA-N. The full InChI is InChI=1S/C14H22O2Te/c1-3-5-11-17-13(8-4-2)12-16-14-9-6-7-10-15-14/h2,8,14H,3,5-7,9-12H2,1H3/b13-8-.
What are the key properties of 2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane?
2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane has a molecular weight of 349.93 g/mol, XLogP of 2.97, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2-butyltellanylpent-2-en-4-ynoxy]oxane is sourced from PubChem (CID 139265703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).