5-trimethylsilylpenta-2,4-diynal

C8H10OSi — CID 11073595

IUPAC5-trimethylsilylpenta-2,4-diynal
SMILESC[Si](C)(C)C#CC#CC=O
InChIInChI=1S/C8H10OSi/c1-10(2,3)8-6-4-5-7-9/h7H,1-3H3
InChIKeyKBKKJIDZWOOKSR-UHFFFAOYSA-N
MW150.25 g/mol
LogP1.07
Rot. Bonds

About 5-trimethylsilylpenta-2,4-diynal

5-trimethylsilylpenta-2,4-diynal (PubChem CID 11073595) has the molecular formula C8H10OSi and a molecular weight of 150.25 g/mol. Its IUPAC name is 5-trimethylsilylpenta-2,4-diynal.

Molecular Properties

Compound Name5-trimethylsilylpenta-2,4-diynal
PubChem CID11073595
Molecular FormulaC8H10OSi
Molecular Weight150.25 g/mol
Exact Mass150.05
IUPAC Name5-trimethylsilylpenta-2,4-diynal
SMILESC[Si](C)(C)C#CC#CC=O
InChIInChI=1S/C8H10OSi/c1-10(2,3)8-6-4-5-7-9/h7H,1-3H3
InChIKeyKBKKJIDZWOOKSR-UHFFFAOYSA-N
XLogP1.07
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.25
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', '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 5-trimethylsilylpenta-2,4-diynal?
The IUPAC name of 5-trimethylsilylpenta-2,4-diynal (CID 11073595) is 5-trimethylsilylpenta-2,4-diynal.
What is the SMILES notation for 5-trimethylsilylpenta-2,4-diynal?
The canonical SMILES for 5-trimethylsilylpenta-2,4-diynal is C[Si](C)(C)C#CC#CC=O.
What is the InChIKey of 5-trimethylsilylpenta-2,4-diynal?
The InChIKey is KBKKJIDZWOOKSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10OSi/c1-10(2,3)8-6-4-5-7-9/h7H,1-3H3.
What are the key properties of 5-trimethylsilylpenta-2,4-diynal?
5-trimethylsilylpenta-2,4-diynal has a molecular weight of 150.25 g/mol, XLogP of 1.07, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-trimethylsilylpenta-2,4-diynal is sourced from PubChem (CID 11073595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).