lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate

C9H19LiO3Si — CID 101062901

IUPAClithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate
SMILESCO/C([O-])=C\O[Si](C)(C)C(C)(C)C.[Li+]
InChIInChI=1S/C9H20O3Si.Li/c1-9(2,3)13(5,6)12-7-8(10)11-4;/h7,10H,1-6H3;/q;+1/p-1/b8-7-;
InChIKeyCOBKFAHKYRAODV-CFYXSCKTSA-M
MW210.27 g/mol
LogP-1.18
Rot. Bonds3

About lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate

lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate (PubChem CID 101062901) has the molecular formula C9H19LiO3Si and a molecular weight of 210.27 g/mol. Its IUPAC name is lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate.

Molecular Properties

Compound Namelithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate
PubChem CID101062901
Molecular FormulaC9H19LiO3Si
Molecular Weight210.27 g/mol
Exact Mass210.13
IUPAC Namelithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate
SMILESCO/C([O-])=C\O[Si](C)(C)C(C)(C)C.[Li+]
InChIInChI=1S/C9H20O3Si.Li/c1-9(2,3)13(5,6)12-7-8(10)11-4;/h7,10H,1-6H3;/q;+1/p-1/b8-7-;
InChIKeyCOBKFAHKYRAODV-CFYXSCKTSA-M
XLogP-1.18
TPSA41.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 5-1.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

tert-butyl-dimethyl-[(Z)-2-trimethylsilyloxyprop-1-enoxy]silane
CID 90756977
(E)-5-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-4-en-2-one
CID 121003101
tert-butyl-[(E)-1,2-dimethoxyethenoxy]-dimethylsilane
CID 15524131
tert-butyl-(4-methoxybuta-1,3-dienoxy)-dimethylsilane
CID 173308840
(Z)-6-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethyl-5-(trimethylsilylmethyl)hex-5-en-3-ol
CID 15498298
3-[tert-butyl(dimethyl)silyl]oxy-2-(propoxyamino)prop-2-enoic acid
CID 90919291
(Z)-2-[tert-butyl(dimethyl)silyl]oxy-N,N-dimethylethenamine
CID 59793232
(E,2S)-1-[tert-butyl(dimethyl)silyl]oxy-4-ethoxybut-3-en-2-ol
CID 102511744
tert-butyl (E)-3-[tert-butyl(dimethyl)silyl]oxyprop-2-enoate
CID 102348097
tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane
CID 11817041
(2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol
CID 11148647
tert-butyl-dimethyl-[(1E,3Z)-3-trimethylsilyloxypenta-1,3-dienoxy]silane
CID 101185110

Frequently Asked Questions

What is the IUPAC name of lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate?
The IUPAC name of lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate (CID 101062901) is lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate.
What is the SMILES notation for lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate?
The canonical SMILES for lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate is CO/C([O-])=C\O[Si](C)(C)C(C)(C)C.[Li+].
What is the InChIKey of lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate?
The InChIKey is COBKFAHKYRAODV-CFYXSCKTSA-M. The full InChI is InChI=1S/C9H20O3Si.Li/c1-9(2,3)13(5,6)12-7-8(10)11-4;/h7,10H,1-6H3;/q;+1/p-1/b8-7-;.
What are the key properties of lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate?
lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate has a molecular weight of 210.27 g/mol, XLogP of -1.18, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium (Z)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxyethenolate is sourced from PubChem (CID 101062901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).