lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane

C10H22BLiO2Si — CID 12841175

IUPAClithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane
SMILESCC1(C)OB([CH-][Si](C)(C)C)OC1(C)C.[Li+]
InChIInChI=1S/C10H22BO2Si.Li/c1-9(2)10(3,4)13-11(12-9)8-14(5,6)7;/h8H,1-7H3;/q-1;+1
InChIKeyCBJSDJGTWVWTAU-UHFFFAOYSA-N
MW220.12 g/mol
LogP-0.30
Rot. Bonds2

About lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane

lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane (PubChem CID 12841175) has the molecular formula C10H22BLiO2Si and a molecular weight of 220.12 g/mol. Its IUPAC name is lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane.

Molecular Properties

Compound Namelithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane
PubChem CID12841175
Molecular FormulaC10H22BLiO2Si
Molecular Weight220.12 g/mol
Exact Mass220.16
IUPAC Namelithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane
SMILESCC1(C)OB([CH-][Si](C)(C)C)OC1(C)C.[Li+]
InChIInChI=1S/C10H22BO2Si.Li/c1-9(2)10(3,4)13-11(12-9)8-14(5,6)7;/h8H,1-7H3;/q-1;+1
InChIKeyCBJSDJGTWVWTAU-UHFFFAOYSA-N
XLogP-0.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.12
LogP ≤ 5-0.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane?
The IUPAC name of lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane (CID 12841175) is lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane.
What is the SMILES notation for lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane?
The canonical SMILES for lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane is CC1(C)OB([CH-][Si](C)(C)C)OC1(C)C.[Li+].
What is the InChIKey of lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane?
The InChIKey is CBJSDJGTWVWTAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22BO2Si.Li/c1-9(2)10(3,4)13-11(12-9)8-14(5,6)7;/h8H,1-7H3;/q-1;+1.
What are the key properties of lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane?
lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane has a molecular weight of 220.12 g/mol, XLogP of -0.30, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane is sourced from PubChem (CID 12841175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).