1-(2-butyltellanylethynyl)cyclohexene

C12H18Te — CID 10902338

IUPAC1-(2-butyltellanylethynyl)cyclohexene
SMILESCCCC[Te]C#CC1=CCCCC1
InChIInChI=1S/C12H18Te/c1-2-3-10-13-11-9-12-7-5-4-6-8-12/h7H,2-6,8,10H2,1H3
InChIKeyOYEGDZPIQSTANT-UHFFFAOYSA-N
MW289.88 g/mol
LogP3.37
Rot. Bonds3

About 1-(2-butyltellanylethynyl)cyclohexene

1-(2-butyltellanylethynyl)cyclohexene (PubChem CID 10902338) has the molecular formula C12H18Te and a molecular weight of 289.88 g/mol. Its IUPAC name is 1-(2-butyltellanylethynyl)cyclohexene.

Molecular Properties

Compound Name1-(2-butyltellanylethynyl)cyclohexene
PubChem CID10902338
Molecular FormulaC12H18Te
Molecular Weight289.88 g/mol
Exact Mass292.05
IUPAC Name1-(2-butyltellanylethynyl)cyclohexene
SMILESCCCC[Te]C#CC1=CCCCC1
InChIInChI=1S/C12H18Te/c1-2-3-10-13-11-9-12-7-5-4-6-8-12/h7H,2-6,8,10H2,1H3
InChIKeyOYEGDZPIQSTANT-UHFFFAOYSA-N
XLogP3.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.88
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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'}

Analyze 1-(2-butyltellanylethynyl)cyclohexene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Terpinolene
CID 11463
gamma-Bisabolene
CID 62346
gamma-BISABOLENE, (E)-
CID 5352437
gamma-Bisabolene, (Z)-
CID 3033866
1-Ethynylcyclohexene
CID 79128
1-Methyl-5-(propan-2-ylidene)cyclohex-1-ene
CID 11040762
(E)-iso-gamma-bisabolene
CID 11458379
1,1'-Ethyne-1,2-diyldicyclohexene
CID 235024
Bisabola-2,6,11-triene
CID 60113331
Cyclohexene, 1-(1-propynyl)-
CID 577619
1-[4-(Cyclohexen-1-yl)buta-1,3-diynyl]cyclohexene
CID 9855843
1-Hex-1-ynyl-cyclohexene
CID 11147892

Frequently Asked Questions

What is the IUPAC name of 1-(2-butyltellanylethynyl)cyclohexene?
The IUPAC name of 1-(2-butyltellanylethynyl)cyclohexene (CID 10902338) is 1-(2-butyltellanylethynyl)cyclohexene.
What is the SMILES notation for 1-(2-butyltellanylethynyl)cyclohexene?
The canonical SMILES for 1-(2-butyltellanylethynyl)cyclohexene is CCCC[Te]C#CC1=CCCCC1.
What is the InChIKey of 1-(2-butyltellanylethynyl)cyclohexene?
The InChIKey is OYEGDZPIQSTANT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18Te/c1-2-3-10-13-11-9-12-7-5-4-6-8-12/h7H,2-6,8,10H2,1H3.
What are the key properties of 1-(2-butyltellanylethynyl)cyclohexene?
1-(2-butyltellanylethynyl)cyclohexene has a molecular weight of 289.88 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-butyltellanylethynyl)cyclohexene is sourced from PubChem (CID 10902338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).