1,3,2-dioxaborolan-2-yl(triphenyl)silane

C20H19BO2Si — CID 101421948

IUPAC1,3,2-dioxaborolan-2-yl(triphenyl)silane
SMILESc1ccc([Si](B2OCCO2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H19BO2Si/c1-4-10-18(11-5-1)24(21-22-16-17-23-21,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17H2
InChIKeyPPGDPPPUQFPNMT-UHFFFAOYSA-N
MW330.27 g/mol
LogP1.77
Rot. Bonds4

About 1,3,2-dioxaborolan-2-yl(triphenyl)silane

1,3,2-dioxaborolan-2-yl(triphenyl)silane (PubChem CID 101421948) has the molecular formula C20H19BO2Si and a molecular weight of 330.27 g/mol. Its IUPAC name is 1,3,2-dioxaborolan-2-yl(triphenyl)silane.

Molecular Properties

Compound Name1,3,2-dioxaborolan-2-yl(triphenyl)silane
PubChem CID101421948
Molecular FormulaC20H19BO2Si
Molecular Weight330.27 g/mol
Exact Mass330.12
IUPAC Name1,3,2-dioxaborolan-2-yl(triphenyl)silane
SMILESc1ccc([Si](B2OCCO2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H19BO2Si/c1-4-10-18(11-5-1)24(21-22-16-17-23-21,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17H2
InChIKeyPPGDPPPUQFPNMT-UHFFFAOYSA-N
XLogP1.77
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.27
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

tetramethylsilane;trimethyl(phenyl)silane
CID 161005748
hydroxy-diphenyl-silylsilane
CID 123329097
1,3,2-dioxaborinan-2-yloxy(triphenyl)silane
CID 102520367
1,3,2-dioxaborinan-2-yloxy-dimethyl-phenylsilane
CID 102520366
2-(2-phenylpropan-2-yl)-1,3,2-dioxaborolane
CID 102529657
2-(1-phenylethenyl)-1,3,2-dioxaborolane
CID 11286739
magnesium;trimethyl(phenyl)silane;dibromide
CID 175580992
[dimethyl(triphenylsilyl)silyl]-dimethyl-triphenylsilylsilane
CID 86205991
[dichloro(phenyl)silyl]phosphane
CID 165358903
trimethyl-(2-triphenylsilylphenyl)silane
CID 91070759
dihydroxy-(oxan-2-yl)-phenylsilane
CID 175286326
(1,3-dimethyl-1,3,2-diazaborolidin-2-yl)-dimethyl-phenylsilane
CID 11064285

Frequently Asked Questions

What is the IUPAC name of 1,3,2-dioxaborolan-2-yl(triphenyl)silane?
The IUPAC name of 1,3,2-dioxaborolan-2-yl(triphenyl)silane (CID 101421948) is 1,3,2-dioxaborolan-2-yl(triphenyl)silane.
What is the SMILES notation for 1,3,2-dioxaborolan-2-yl(triphenyl)silane?
The canonical SMILES for 1,3,2-dioxaborolan-2-yl(triphenyl)silane is c1ccc([Si](B2OCCO2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 1,3,2-dioxaborolan-2-yl(triphenyl)silane?
The InChIKey is PPGDPPPUQFPNMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19BO2Si/c1-4-10-18(11-5-1)24(21-22-16-17-23-21,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17H2.
What are the key properties of 1,3,2-dioxaborolan-2-yl(triphenyl)silane?
1,3,2-dioxaborolan-2-yl(triphenyl)silane has a molecular weight of 330.27 g/mol, XLogP of 1.77, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,2-dioxaborolan-2-yl(triphenyl)silane is sourced from PubChem (CID 101421948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).