9-trimethylsilylnon-8-ynal

C12H22OSi — CID 11264297

IUPAC9-trimethylsilylnon-8-ynal
SMILESC[Si](C)(C)C#CCCCCCCC=O
InChIInChI=1S/C12H22OSi/c1-14(2,3)12-10-8-6-4-5-7-9-11-13/h11H,4-9H2,1-3H3
InChIKeyLWNMJMLDEYZXRV-UHFFFAOYSA-N
MW210.39 g/mol
LogP3.41
Rot. Bonds6

About 9-trimethylsilylnon-8-ynal

9-trimethylsilylnon-8-ynal (PubChem CID 11264297) has the molecular formula C12H22OSi and a molecular weight of 210.39 g/mol. Its IUPAC name is 9-trimethylsilylnon-8-ynal.

Molecular Properties

Compound Name9-trimethylsilylnon-8-ynal
PubChem CID11264297
Molecular FormulaC12H22OSi
Molecular Weight210.39 g/mol
Exact Mass210.14
IUPAC Name9-trimethylsilylnon-8-ynal
SMILESC[Si](C)(C)C#CCCCCCCC=O
InChIInChI=1S/C12H22OSi/c1-14(2,3)12-10-8-6-4-5-7-9-11-13/h11H,4-9H2,1-3H3
InChIKeyLWNMJMLDEYZXRV-UHFFFAOYSA-N
XLogP3.41
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.39
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'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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Related Compounds

8-trimethylsilyloct-7-ynal
CID 24795453
octadec-6-ynal
CID 87656650
8-chlorooct-1-ynyl(trimethyl)silane
CID 14451681
9-trimethylsilylnon-8-yne-1-thiol
CID 150811852
8-iodooct-1-ynyl(trimethyl)silane
CID 14451683
triaconta-14,16-diynal
CID 54246373
tricosa-10,12-diynal
CID 54454154
chloro-dimethyl-(13-trimethylsilyltridec-12-ynyl)silane
CID 14618616
pentadecanedial
CID 22887412
methyl-phosphanyl-[(Z)-10-trimethylsilyldec-1-en-9-ynoxy]phosphane
CID 58460814
trimethyl(octa-6,7-dien-1-ynyl)silane
CID 10932018
8-trimethylsilyloctanal
CID 164916238

Frequently Asked Questions

What is the IUPAC name of 9-trimethylsilylnon-8-ynal?
The IUPAC name of 9-trimethylsilylnon-8-ynal (CID 11264297) is 9-trimethylsilylnon-8-ynal.
What is the SMILES notation for 9-trimethylsilylnon-8-ynal?
The canonical SMILES for 9-trimethylsilylnon-8-ynal is C[Si](C)(C)C#CCCCCCCC=O.
What is the InChIKey of 9-trimethylsilylnon-8-ynal?
The InChIKey is LWNMJMLDEYZXRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22OSi/c1-14(2,3)12-10-8-6-4-5-7-9-11-13/h11H,4-9H2,1-3H3.
What are the key properties of 9-trimethylsilylnon-8-ynal?
9-trimethylsilylnon-8-ynal has a molecular weight of 210.39 g/mol, XLogP of 3.41, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-trimethylsilylnon-8-ynal is sourced from PubChem (CID 11264297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).