1-trimethylsilyldec-1-yn-3-ol

C13H26OSi — CID 10955284

IUPAC1-trimethylsilyldec-1-yn-3-ol
SMILESCCCCCCCC(O)C#C[Si](C)(C)C
InChIInChI=1S/C13H26OSi/c1-5-6-7-8-9-10-13(14)11-12-15(2,3)4/h13-14H,5-10H2,1-4H3
InChIKeyKGFXSPBJDFBTEO-UHFFFAOYSA-N
MW226.44 g/mol
LogP3.59
Rot. Bonds6

About 1-trimethylsilyldec-1-yn-3-ol

1-trimethylsilyldec-1-yn-3-ol (PubChem CID 10955284) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is 1-trimethylsilyldec-1-yn-3-ol.

Molecular Properties

Compound Name1-trimethylsilyldec-1-yn-3-ol
PubChem CID10955284
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Name1-trimethylsilyldec-1-yn-3-ol
SMILESCCCCCCCC(O)C#C[Si](C)(C)C
InChIInChI=1S/C13H26OSi/c1-5-6-7-8-9-10-13(14)11-12-15(2,3)4/h13-14H,5-10H2,1-4H3
InChIKeyKGFXSPBJDFBTEO-UHFFFAOYSA-N
XLogP3.59
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 53.59
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-trimethylsilyldec-1-yn-3-ol?
The IUPAC name of 1-trimethylsilyldec-1-yn-3-ol (CID 10955284) is 1-trimethylsilyldec-1-yn-3-ol.
What is the SMILES notation for 1-trimethylsilyldec-1-yn-3-ol?
The canonical SMILES for 1-trimethylsilyldec-1-yn-3-ol is CCCCCCCC(O)C#C[Si](C)(C)C.
What is the InChIKey of 1-trimethylsilyldec-1-yn-3-ol?
The InChIKey is KGFXSPBJDFBTEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26OSi/c1-5-6-7-8-9-10-13(14)11-12-15(2,3)4/h13-14H,5-10H2,1-4H3.
What are the key properties of 1-trimethylsilyldec-1-yn-3-ol?
1-trimethylsilyldec-1-yn-3-ol has a molecular weight of 226.44 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-trimethylsilyldec-1-yn-3-ol is sourced from PubChem (CID 10955284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).