tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane

C17H33BO2Si — CID 25058448

IUPACtri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane
SMILESCC(C)[Si](C#CB1OC(C)(C)C(C)(C)O1)(C(C)C)C(C)C
InChIInChI=1S/C17H33BO2Si/c1-13(2)21(14(3)4,15(5)6)12-11-18-19-16(7,8)17(9,10)20-18/h13-15H,1-10H3
InChIKeyNFKGSGUDVJBYJG-UHFFFAOYSA-N
MW308.35 g/mol
LogP4.84
Rot. Bonds3

About tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane

tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane (PubChem CID 25058448) has the molecular formula C17H33BO2Si and a molecular weight of 308.35 g/mol. Its IUPAC name is tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane.

Molecular Properties

Compound Nametri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane
PubChem CID25058448
Molecular FormulaC17H33BO2Si
Molecular Weight308.35 g/mol
Exact Mass308.23
IUPAC Nametri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane
SMILESCC(C)[Si](C#CB1OC(C)(C)C(C)(C)O1)(C(C)C)C(C)C
InChIInChI=1S/C17H33BO2Si/c1-13(2)21(14(3)4,15(5)6)12-11-18-19-16(7,8)17(9,10)20-18/h13-15H,1-10H3
InChIKeyNFKGSGUDVJBYJG-UHFFFAOYSA-N
XLogP4.84
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.35
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Trimethyl[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane
CID 11447422
1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-[1-(trimethylsilyl)ethenyl]-
CID 12157928
Trimethyl[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-1-yn-1-yl]silane
CID 14742407
Triethyl(tetramethyl-1,3,2-dioxaborolan-2-yl)silane
CID 102128834
2-Trimethylsilyl-1-ethylboronic acid pinacol ester
CID 11436111
4,4,5,5-Tetramethyl-2-[(trimethylsilyl)methyl]-1,3,2-dioxaborolane
CID 12569882
trimethyl-[(1S,2S)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclopropyl]silane
CID 21592813
Tert-butyl-dimethyl-[2-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propoxy]silane
CID 151148555
Trimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-1-ynyl]silane
CID 11010916
Lithium trimethyl-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]silane
CID 12841175
Tert-butyl-dimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-ynoxy]silane
CID 14927838
tri(propan-2-yl)-[(Z)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]silane
CID 25058449

Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane?
The IUPAC name of tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane (CID 25058448) is tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane.
What is the SMILES notation for tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane?
The canonical SMILES for tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane is CC(C)[Si](C#CB1OC(C)(C)C(C)(C)O1)(C(C)C)C(C)C.
What is the InChIKey of tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane?
The InChIKey is NFKGSGUDVJBYJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33BO2Si/c1-13(2)21(14(3)4,15(5)6)12-11-18-19-16(7,8)17(9,10)20-18/h13-15H,1-10H3.
What are the key properties of tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane?
tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane has a molecular weight of 308.35 g/mol, XLogP of 4.84, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane is sourced from PubChem (CID 25058448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).