lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane

C15H27LiSi — CID 10752708

IUPAClithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane
SMILESCC(C)=CCC[C@@H](C)C[CH-]C#C[Si](C)(C)C.[Li+]
InChIInChI=1S/C15H27Si.Li/c1-14(2)10-9-12-15(3)11-7-8-13-16(4,5)6;/h7,10,15H,9,11-12H2,1-6H3;/q-1;+1/t15-;/m0./s1
InChIKeyRNROASDKVZIAIB-RSAXXLAASA-N
MW242.41 g/mol
LogP1.85
Rot. Bonds5

About lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane

lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane (PubChem CID 10752708) has the molecular formula C15H27LiSi and a molecular weight of 242.41 g/mol. Its IUPAC name is lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Namelithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane
PubChem CID10752708
Molecular FormulaC15H27LiSi
Molecular Weight242.41 g/mol
Exact Mass242.20
IUPAC Namelithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane
SMILESCC(C)=CCC[C@@H](C)C[CH-]C#C[Si](C)(C)C.[Li+]
InChIInChI=1S/C15H27Si.Li/c1-14(2)10-9-12-15(3)11-7-8-13-16(4,5)6;/h7,10,15H,9,11-12H2,1-6H3;/q-1;+1/t15-;/m0./s1
InChIKeyRNROASDKVZIAIB-RSAXXLAASA-N
XLogP1.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane?
The IUPAC name of lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane (CID 10752708) is lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane.
What is the SMILES notation for lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane?
The canonical SMILES for lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane is CC(C)=CCC[C@@H](C)C[CH-]C#C[Si](C)(C)C.[Li+].
What is the InChIKey of lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane?
The InChIKey is RNROASDKVZIAIB-RSAXXLAASA-N. The full InChI is InChI=1S/C15H27Si.Li/c1-14(2)10-9-12-15(3)11-7-8-13-16(4,5)6;/h7,10,15H,9,11-12H2,1-6H3;/q-1;+1/t15-;/m0./s1.
What are the key properties of lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane?
lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane has a molecular weight of 242.41 g/mol, XLogP of 1.85, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium [(5S)-5,9-dimethyldec-8-en-1-ynyl]-trimethylsilane is sourced from PubChem (CID 10752708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).