lithium tert-butyl-but-3-ynoxy-dimethylsilane

C10H19LiOSi — CID 11063224

IUPAClithium tert-butyl-but-3-ynoxy-dimethylsilane
SMILES[C-]#CCCO[Si](C)(C)C(C)(C)C.[Li+]
InChIInChI=1S/C10H19OSi.Li/c1-7-8-9-11-12(5,6)10(2,3)4;/h8-9H2,2-6H3;/q-1;+1
InChIKeyMMURXXUSPHDSPV-UHFFFAOYSA-N
MW190.29 g/mol
LogP-0.01
Rot. Bonds3

About lithium tert-butyl-but-3-ynoxy-dimethylsilane

lithium tert-butyl-but-3-ynoxy-dimethylsilane (PubChem CID 11063224) has the molecular formula C10H19LiOSi and a molecular weight of 190.29 g/mol. Its IUPAC name is lithium tert-butyl-but-3-ynoxy-dimethylsilane.

Molecular Properties

Compound Namelithium tert-butyl-but-3-ynoxy-dimethylsilane
PubChem CID11063224
Molecular FormulaC10H19LiOSi
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Namelithium tert-butyl-but-3-ynoxy-dimethylsilane
SMILES[C-]#CCCO[Si](C)(C)C(C)(C)C.[Li+]
InChIInChI=1S/C10H19OSi.Li/c1-7-8-9-11-12(5,6)10(2,3)4;/h8-9H2,2-6H3;/q-1;+1
InChIKeyMMURXXUSPHDSPV-UHFFFAOYSA-N
XLogP-0.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 5-0.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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tert-butyl-dimethyl-(6-trimethylsilylhexa-3,5-diynoxy)silane
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tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexoxy]-dimethylsilane
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tert-butyl-[10-[tert-butyl(dimethyl)silyl]oxydecoxy]-dimethylsilane
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5-[tert-butyl(dimethyl)silyl]oxypent-2-ynyl methanesulfonate
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O-[2-[tert-butyl(dimethyl)silyl]oxyethyl]hydroxylamine
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tert-butyl-[(Z)-6-chlorohex-5-en-3-ynoxy]-dimethylsilane
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tert-butyl-hexadec-15-ynoxy-dimethylsilane
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2-[tert-butyl(dimethyl)silyl]oxy-N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]ethanamine
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Frequently Asked Questions

What is the IUPAC name of lithium tert-butyl-but-3-ynoxy-dimethylsilane?
The IUPAC name of lithium tert-butyl-but-3-ynoxy-dimethylsilane (CID 11063224) is lithium tert-butyl-but-3-ynoxy-dimethylsilane.
What is the SMILES notation for lithium tert-butyl-but-3-ynoxy-dimethylsilane?
The canonical SMILES for lithium tert-butyl-but-3-ynoxy-dimethylsilane is [C-]#CCCO[Si](C)(C)C(C)(C)C.[Li+].
What is the InChIKey of lithium tert-butyl-but-3-ynoxy-dimethylsilane?
The InChIKey is MMURXXUSPHDSPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19OSi.Li/c1-7-8-9-11-12(5,6)10(2,3)4;/h8-9H2,2-6H3;/q-1;+1.
What are the key properties of lithium tert-butyl-but-3-ynoxy-dimethylsilane?
lithium tert-butyl-but-3-ynoxy-dimethylsilane has a molecular weight of 190.29 g/mol, XLogP of -0.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium tert-butyl-but-3-ynoxy-dimethylsilane is sourced from PubChem (CID 11063224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).