bromo(triethyl)silane;tetraphenylboranuide

C30H35BBrSi- — CID 174492282

IUPACbromo(triethyl)silane;tetraphenylboranuide
SMILESCC[Si](Br)(CC)CC.c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H20B.C6H15BrSi/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-4-8(7,5-2)6-3/h1-20H;4-6H2,1-3H3/q-1;
InChIKeyWXSGKSGTYFALSD-UHFFFAOYSA-N
MW514.41 g/mol
LogP6.45
Rot. Bonds7

About bromo(triethyl)silane;tetraphenylboranuide

bromo(triethyl)silane;tetraphenylboranuide (PubChem CID 174492282) has the molecular formula C30H35BBrSi- and a molecular weight of 514.41 g/mol. Its IUPAC name is bromo(triethyl)silane;tetraphenylboranuide.

Molecular Properties

Compound Namebromo(triethyl)silane;tetraphenylboranuide
PubChem CID174492282
Molecular FormulaC30H35BBrSi-
Molecular Weight514.41 g/mol
Exact Mass513.18
IUPAC Namebromo(triethyl)silane;tetraphenylboranuide
SMILESCC[Si](Br)(CC)CC.c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H20B.C6H15BrSi/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-4-8(7,5-2)6-3/h1-20H;4-6H2,1-3H3/q-1;
InChIKeyWXSGKSGTYFALSD-UHFFFAOYSA-N
XLogP6.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500514.41
LogP ≤ 56.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze bromo(triethyl)silane;tetraphenylboranuide 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

methanamine;tetraphenylboranuide
CID 175835863
tetraphenylboranuide;triethylazanium
CID 11080326
dimethylphosphanium;tetraphenylboranuide
CID 174900648
calcium;tetraphenylboranuide;iodide
CID 23136649
CID 174934257
CID 174934257
tetraphenylboranuide tetrafluoroborate
CID 87564099
hydroxyazanium;tetraphenylboranuide
CID 171792531
tetraphenylboranuide;tritert-butylphosphane
CID 86674235
tert-butyliodanium;tetraphenylboranuide
CID 156646741
tetraphenylboranuide;trimethyl(phenyl)azanium
CID 12504234
bis(4-tert-butylphenyl)-diphenylboranuide
CID 176879927
methyl(tetradecyl)azanium;tetraphenylboranuide
CID 175491295

Frequently Asked Questions

What is the IUPAC name of bromo(triethyl)silane;tetraphenylboranuide?
The IUPAC name of bromo(triethyl)silane;tetraphenylboranuide (CID 174492282) is bromo(triethyl)silane;tetraphenylboranuide.
What is the SMILES notation for bromo(triethyl)silane;tetraphenylboranuide?
The canonical SMILES for bromo(triethyl)silane;tetraphenylboranuide is CC[Si](Br)(CC)CC.c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of bromo(triethyl)silane;tetraphenylboranuide?
The InChIKey is WXSGKSGTYFALSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20B.C6H15BrSi/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-4-8(7,5-2)6-3/h1-20H;4-6H2,1-3H3/q-1;.
What are the key properties of bromo(triethyl)silane;tetraphenylboranuide?
bromo(triethyl)silane;tetraphenylboranuide has a molecular weight of 514.41 g/mol, XLogP of 6.45, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromo(triethyl)silane;tetraphenylboranuide is sourced from PubChem (CID 174492282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).