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

C14H27BO2Si — CID 11010916

IUPACtrimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane
SMILESCC1(C)OB(CCCC#C[Si](C)(C)C)OC1(C)C
InChIInChI=1S/C14H27BO2Si/c1-13(2)14(3,4)17-15(16-13)11-9-8-10-12-18(5,6)7/h8-9,11H2,1-7H3
InChIKeyXDUSLFNKSBUUOP-UHFFFAOYSA-N
MW266.27 g/mol
LogP3.74
Rot. Bonds3

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

trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane (PubChem CID 11010916) has the molecular formula C14H27BO2Si and a molecular weight of 266.27 g/mol. Its IUPAC name is trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane
PubChem CID11010916
Molecular FormulaC14H27BO2Si
Molecular Weight266.27 g/mol
Exact Mass266.19
IUPAC Nametrimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane
SMILESCC1(C)OB(CCCC#C[Si](C)(C)C)OC1(C)C
InChIInChI=1S/C14H27BO2Si/c1-13(2)14(3,4)17-15(16-13)11-9-8-10-12-18(5,6)7/h8-9,11H2,1-7H3
InChIKeyXDUSLFNKSBUUOP-UHFFFAOYSA-N
XLogP3.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.27
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane?
The IUPAC name of trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane (CID 11010916) is trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane.
What is the SMILES notation for trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane?
The canonical SMILES for trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane is CC1(C)OB(CCCC#C[Si](C)(C)C)OC1(C)C.
What is the InChIKey of trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane?
The InChIKey is XDUSLFNKSBUUOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27BO2Si/c1-13(2)14(3,4)17-15(16-13)11-9-8-10-12-18(5,6)7/h8-9,11H2,1-7H3.
What are the key properties of trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane?
trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane has a molecular weight of 266.27 g/mol, XLogP of 3.74, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane is sourced from PubChem (CID 11010916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).