1-trimethylsilyldeca-1,3-diyn-5-ol

C13H22OSi — CID 10513261

IUPAC1-trimethylsilyldeca-1,3-diyn-5-ol
SMILESCCCCCC(O)C#CC#C[Si](C)(C)C
InChIInChI=1S/C13H22OSi/c1-5-6-7-10-13(14)11-8-9-12-15(2,3)4/h13-14H,5-7,10H2,1-4H3
InChIKeyYICBTWWMZKDJEZ-UHFFFAOYSA-N
MW222.40 g/mol
LogP2.81
Rot. Bonds4

About 1-trimethylsilyldeca-1,3-diyn-5-ol

1-trimethylsilyldeca-1,3-diyn-5-ol (PubChem CID 10513261) has the molecular formula C13H22OSi and a molecular weight of 222.40 g/mol. Its IUPAC name is 1-trimethylsilyldeca-1,3-diyn-5-ol.

Molecular Properties

Compound Name1-trimethylsilyldeca-1,3-diyn-5-ol
PubChem CID10513261
Molecular FormulaC13H22OSi
Molecular Weight222.40 g/mol
Exact Mass222.14
IUPAC Name1-trimethylsilyldeca-1,3-diyn-5-ol
SMILESCCCCCC(O)C#CC#C[Si](C)(C)C
InChIInChI=1S/C13H22OSi/c1-5-6-7-10-13(14)11-8-9-12-15(2,3)4/h13-14H,5-7,10H2,1-4H3
InChIKeyYICBTWWMZKDJEZ-UHFFFAOYSA-N
XLogP2.81
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.40
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 1-trimethylsilyldeca-1,3-diyn-5-ol?
The IUPAC name of 1-trimethylsilyldeca-1,3-diyn-5-ol (CID 10513261) is 1-trimethylsilyldeca-1,3-diyn-5-ol.
What is the SMILES notation for 1-trimethylsilyldeca-1,3-diyn-5-ol?
The canonical SMILES for 1-trimethylsilyldeca-1,3-diyn-5-ol is CCCCCC(O)C#CC#C[Si](C)(C)C.
What is the InChIKey of 1-trimethylsilyldeca-1,3-diyn-5-ol?
The InChIKey is YICBTWWMZKDJEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22OSi/c1-5-6-7-10-13(14)11-8-9-12-15(2,3)4/h13-14H,5-7,10H2,1-4H3.
What are the key properties of 1-trimethylsilyldeca-1,3-diyn-5-ol?
1-trimethylsilyldeca-1,3-diyn-5-ol has a molecular weight of 222.40 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-trimethylsilyldeca-1,3-diyn-5-ol is sourced from PubChem (CID 10513261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).