1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol

C11H20OSi2 — CID 11107012

IUPAC1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol
SMILESC[Si](C)(C)C#CC(O)C#C[Si](C)(C)C
InChIInChI=1S/C11H20OSi2/c1-13(2,3)9-7-11(12)8-10-14(4,5)6/h11-12H,1-6H3
InChIKeyCVMUTDAOOAZSQA-UHFFFAOYSA-N
MW224.45 g/mol
LogP2.11
Rot. Bonds

About 1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol

1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol (PubChem CID 11107012) has the molecular formula C11H20OSi2 and a molecular weight of 224.45 g/mol. Its IUPAC name is 1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol.

Molecular Properties

Compound Name1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol
PubChem CID11107012
Molecular FormulaC11H20OSi2
Molecular Weight224.45 g/mol
Exact Mass224.11
IUPAC Name1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol
SMILESC[Si](C)(C)C#CC(O)C#C[Si](C)(C)C
InChIInChI=1S/C11H20OSi2/c1-13(2,3)9-7-11(12)8-10-14(4,5)6/h11-12H,1-6H3
InChIKeyCVMUTDAOOAZSQA-UHFFFAOYSA-N
XLogP2.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.45
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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 1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol?
The IUPAC name of 1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol (CID 11107012) is 1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol.
What is the SMILES notation for 1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol?
The canonical SMILES for 1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol is C[Si](C)(C)C#CC(O)C#C[Si](C)(C)C.
What is the InChIKey of 1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol?
The InChIKey is CVMUTDAOOAZSQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20OSi2/c1-13(2,3)9-7-11(12)8-10-14(4,5)6/h11-12H,1-6H3.
What are the key properties of 1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol?
1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol has a molecular weight of 224.45 g/mol, XLogP of 2.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-bis(trimethylsilyl)penta-1,4-diyn-3-ol is sourced from PubChem (CID 11107012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).