lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane

C10H19LiOSi — CID 10867151

IUPAClithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane
SMILES[C-]#C[C@H](C)O[Si](C)(C)C(C)(C)C.[Li+]
InChIInChI=1S/C10H19OSi.Li/c1-8-9(2)11-12(6,7)10(3,4)5;/h9H,2-7H3;/q-1;+1/t9-;/m0./s1
InChIKeySRDBHPPQQIFWOO-FVGYRXGTSA-N
MW190.29 g/mol
LogP-0.01
Rot. Bonds2

About lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane

lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane (PubChem CID 10867151) has the molecular formula C10H19LiOSi and a molecular weight of 190.29 g/mol. Its IUPAC name is lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane.

Molecular Properties

Compound Namelithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane
PubChem CID10867151
Molecular FormulaC10H19LiOSi
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Namelithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane
SMILES[C-]#C[C@H](C)O[Si](C)(C)C(C)(C)C.[Li+]
InChIInChI=1S/C10H19OSi.Li/c1-8-9(2)11-12(6,7)10(3,4)5;/h9H,2-7H3;/q-1;+1/t9-;/m0./s1
InChIKeySRDBHPPQQIFWOO-FVGYRXGTSA-N
XLogP-0.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
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': '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

tert-butyl-[(2S,11S)-11-[tert-butyl(dimethyl)silyl]oxydodeca-3,5,7,9-tetrayn-2-yl]oxy-dimethylsilane
CID 11223738
CID 11135215
CID 11135215
tert-butyl-(5-methoxypent-3-yn-2-yloxy)-dimethylsilane
CID 100936531
1-[tert-butyl(dimethyl)silyl]oxyethanol
CID 22038232
tert-butyl-dimethyl-(3-methylbut-3-en-2-yloxy)silane
CID 15935934
(2R)-2-[tert-butyl(dimethyl)silyl]oxypropanoic acid
CID 14358757
tert-butyl-[(1S)-1-methoxyethoxy]-dimethylsilane
CID 153446307
3-[tert-butyl(dimethyl)silyl]oxybutan-2-amine
CID 19432382
tert-butyl-dimethyl-pent-4-yn-2-yloxysilane
CID 588048
lithium tert-butyl-dimethyl-[(2R)-pentan-2-yl]oxysilane
CID 177428939
(3S)-1,1-dibromo-3-[tert-butyl(dimethyl)silyl]oxybutan-2-one
CID 10970420
butan-2-yloxy-tert-butyl-dimethylsilane;methane
CID 158755840

Frequently Asked Questions

What is the IUPAC name of lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane?
The IUPAC name of lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane (CID 10867151) is lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane.
What is the SMILES notation for lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane?
The canonical SMILES for lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane is [C-]#C[C@H](C)O[Si](C)(C)C(C)(C)C.[Li+].
What is the InChIKey of lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane?
The InChIKey is SRDBHPPQQIFWOO-FVGYRXGTSA-N. The full InChI is InChI=1S/C10H19OSi.Li/c1-8-9(2)11-12(6,7)10(3,4)5;/h9H,2-7H3;/q-1;+1/t9-;/m0./s1.
What are the key properties of lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane?
lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane has a molecular weight of 190.29 g/mol, XLogP of -0.01, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane is sourced from PubChem (CID 10867151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).