(4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane

C16H17F3O2Te — CID 10862818

IUPAC(4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane
SMILESC=CCOCC1C/C(=C\[Te]c2ccc(C(F)(F)F)cc2)CO1
InChIInChI=1S/C16H17F3O2Te/c1-2-7-20-10-14-8-12(9-21-14)11-22-15-5-3-13(4-6-15)16(17,18)19/h2-6,11,14H,1,7-10H2/b12-11+
InChIKeyWUWRXKHSBLTMOV-VAWYXSNFSA-N
MW425.90 g/mol
LogP2.91
Rot. Bonds6

About (4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane

(4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane (PubChem CID 10862818) has the molecular formula C16H17F3O2Te and a molecular weight of 425.90 g/mol. Its IUPAC name is (4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane.

Molecular Properties

Compound Name(4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane
PubChem CID10862818
Molecular FormulaC16H17F3O2Te
Molecular Weight425.90 g/mol
Exact Mass428.02
IUPAC Name(4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane
SMILESC=CCOCC1C/C(=C\[Te]c2ccc(C(F)(F)F)cc2)CO1
InChIInChI=1S/C16H17F3O2Te/c1-2-7-20-10-14-8-12(9-21-14)11-22-15-5-3-13(4-6-15)16(17,18)19/h2-6,11,14H,1,7-10H2/b12-11+
InChIKeyWUWRXKHSBLTMOV-VAWYXSNFSA-N
XLogP2.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.90
LogP ≤ 52.91
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': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(4Z)-2-(phenylmethoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane
CID 10600656
1-(3-Prop-2-enoxy-2-prop-2-ynoxypropyl)tellanyl-4-(trifluoromethyl)benzene
CID 10895184
2-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane
CID 11550489
(4Z)-2-ethyl-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane
CID 15274722
(4Z)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane
CID 15274724
(4Z)-2-but-3-enyl-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane
CID 102063740
(4E)-2-but-3-enyl-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane
CID 134931970
(4E)-2-ethyl-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane
CID 134932058
(4Z)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]-2-oxabicyclo[3.1.0]hexane
CID 134932262
(4E)-2-(phenylmethoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane
CID 134932372
[(E)-3-(1-cyclohex-2-en-1-yl-2,2,2-trifluoroethoxy)prop-1-enyl]benzene
CID 134971813
(4E)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]-2-oxabicyclo[3.1.0]hexane
CID 134993266

Frequently Asked Questions

What is the IUPAC name of (4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane?
The IUPAC name of (4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane (CID 10862818) is (4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane.
What is the SMILES notation for (4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane?
The canonical SMILES for (4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane is C=CCOCC1C/C(=C\[Te]c2ccc(C(F)(F)F)cc2)CO1.
What is the InChIKey of (4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane?
The InChIKey is WUWRXKHSBLTMOV-VAWYXSNFSA-N. The full InChI is InChI=1S/C16H17F3O2Te/c1-2-7-20-10-14-8-12(9-21-14)11-22-15-5-3-13(4-6-15)16(17,18)19/h2-6,11,14H,1,7-10H2/b12-11+.
What are the key properties of (4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane?
(4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane has a molecular weight of 425.90 g/mol, XLogP of 2.91, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-2-(prop-2-enoxymethyl)-4-[[4-(trifluoromethyl)phenyl]tellanylmethylidene]oxolane is sourced from PubChem (CID 10862818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).